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Humic acid (HA), as an important part of natural organic matter (NOM), is a precursor of disinfection byproducts. HA affects the migration and transformation of inorganic substances such as metal ions, causing direct harm to the ecological environment and human health. Therefore, HA removal is an important aspect of geochemical research. In this review, research on the application of biochar and modified biochar, which exhibit excellent removal capability, in the treatment of HA-like NOM in water is summarized. The different mechanisms of HA removal via biochar are discussed by analyzing the structure-activity relationship of biochar in the removal of NOM in water under various influencing conditions. The performance and mechanism of adsorption, Fenton, photocatalysis, and electrochemical oxidation methods are analyzed, and their advantages and disadvantages are compared. Finally, the application potential and development direction of multifunctional biochar materials for the removal of NOM, including HA, from water are reviewed. This review provides theoretical and technical support for the removal of HA-like NOM in water using biochar materials and provides a novel direction for its application in actual water bodies. Highlights: The removal of HA based on biochar is affected by the source, pyrolysis temperature, and modification method of biochar. HA is adsorbed by biochar through pore filling, electrostatic interactions, π-π stacking, and hydrogen bonding. HA is oxidized by biochar through active free radicals such as ⋅OH, ⋅O2−, SO4−⋅, and 1O2. [ABSTRACT FROM AUTHOR]

Biological mechanisms of exposure to Trihalomethanes (THMs) in swimming pools remain unclear. Investigation of short-term changes in metabolomic profiles due to exposure to THMs during swimming can help to understand the health effects-related mechanisms. With this in view, we aimed to assess exposure of swimmers to THMs in chlorine and ozone-chlorine swimming pools using the metabolomics approach from September 2020 to January 2021 in Tehran. Two parallel panels of 29 healthy adult subjects swam over 60 min in either of swimming pools. Blood samples were collected before and 2 h after swimming to assess metabolomic profile using Hydrogen-Nuclear Magnetic Resonance Spectroscopy (H-NMR). Differential metabolites between the two groups were identified by multivariate analysis methods such as Orthogonal Partial Least-Squares Discriminant Analysis (OPLS-DA) and Random Forest (RF). The levels of THMs in exhaled air as a biomarker of exposure and the metabolic profile as a biomarker of the effect changed significantly between two participants of swimming pools. Based on the significant metabolites, the biochemical pathways were identified by the method of Metabolite Setts Enrichment Analysis (MSEA) and by using the Metaboanalyst platform. The pathways of tryptophan metabolism, galactose metabolism and fructose and mannose metabolism were the most important biochemically significant pathways in individuals after exposure to THMs. Finally, findings from metabolic changes in our study indicate that exposure to THMs in swimming pools can activate the mechanisms of central nervous system disorders, increased uric acid, increased risk of bladder cancer and oxidative stress. [ABSTRACT FROM AUTHOR]

The presence of two new disinfectant by-product (DBP) groups in the UK was recently shown using non-target analysis, halogenated-hydroxycyclopentenediones and halogenated-methanesulfonic acids. In this work, we confirmed the structure of 2,2,4-tribromo-5-hydroxycyclopent-4-ene-1,3-dione (TBHCD), and quantified it together with dibromomethanesulfonic acid at 122 ± 34 and 326 ± 157 ng L−1 on average in London's drinking water, respectively (n = 21). We found TBHCD to be photolabile and unstable in tap water and at alkaline pH. Furthermore, spectral and computational data for TBHCD and three other halogenated-hydroxycyclopentenediones indicated they could act as a source of radicals in water and in the body. Importantly, TBHCD was calculated to have a 14.5 kcal mol−1 lower C-Br bond dissociation enthalpy than the N-Br bond of N-bromosuccinimide, a common radical substitution reagent used in organic synthesis. TBHCD was mutagenic in Salmonella/microsome assays using strains TA98, TA100 and TA102. This work reveals the unique features, activity and toxicity of trihalogenated hydroxycyclopent-4-ene-1,3-diones, prompting a need to more comprehensively assess their risks. Halogenated disinfection by-products are a recognized health risk, but unequivocal identification and monitoring of new compounds is challenging, which prevents risk assessment. Here, the authors identify and quantify 2,2,4-tribromo-5-hydroxycyclopent-4-ene-1,3-dione in London drinking water, and describe the compound's activity and toxicity. [ABSTRACT FROM AUTHOR]

Water serves as a critical vector for the transmission of pathogenic microorganisms, playing a pivotal role in the emergence and propagation of numerous diseases. Ozone (O3) disinfection technology offers promising potential for mitigating the spread of these pathogens in aquatic environments. However, previous studies have only focused on the inactivated effect of O3 on a single pathogenic microorganism, lacking a comprehensive comparative analysis of various influencing factors and different types of pathogens, while the cost-effectiveness of O3 technology has not been mentioned. This review synthesized the migration characteristics of various pathogenic microorganisms in water bodies and examined the properties, mechanisms, and influencing factors of O3 inactivation. It evaluated the efficacy of O3 against diverse pathogens, namely bacteria, viruses, protozoa, and fungi, and provided a comparative analysis of their sensitivities to O3. The formation and impact of harmful disinfection by-products (DBPs) during the O3 inactivation process were assessed, alongside an analysis of the cost-effectiveness of this method. Additionally, potential synergistic treatment processes involving O3 were proposed. Based on these findings, recommendations were made for optimizing the utilization of O3 in water inactivation in order to formulate better inactivation strategies in the post-pandemic eras. [ABSTRACT FROM AUTHOR]

Pavement deflection is generally obtained by means of Falling Weight Deflectometer (FWD) tests, which provide an evaluation of the structural behavior of highway constructions and indicate the evolution of pavement damage through time. This paper evaluated FWD data, backcalculated moduli, and deflection basin parameters (DBPs) (radius of curvature, area, structural curvature index, base damage index, and base curvature index) to analyze the structural performance of an experimental road pavement test section with four different asphalt pavement segments. The segments had different base layer materials, and they were constituted by one flexible structure (unbound granular base layer), one semi-rigid (cement-treated base layer), one cold recycled asphalt mixture layer stabilized with asphalt emulsion (CRAM-EM), and one cold recycled asphalt mixture layer stabilized with foamed asphalt (CRAM-AF). The field monitoring had eight surveys that included the evaluation of surface distresses and deflection measurements along 3 years of study. The backcalculated moduli of the asphalt layer, base, and remaining pavement structure presented an overall good correlation with the DBPs evaluated. [ABSTRACT FROM AUTHOR]

The article "New trends in the environmental analysis of pollutants" published in Analytical & Bioanalytical Chemistry highlights the importance of monitoring pollutants to protect human and environmental health in the face of climate change. Various review articles in the collection discuss topics such as per- and polyfluoroalkyl substances (PFAS), disinfection byproducts (DBPs), high-throughput effect-directed analysis (HT-EDA), non-targeted screening (NTS) with liquid chromatography coupled to high-resolution mass spectrometry (LC-HRMS), wastewater-based epidemiology (WBE), and analyzing organic micropollutants in vertebrate liver tissues. The authors provide insights into the latest advances, current state of the art, and future perspectives in environmental analysis of pollutants. [Extracted from the article]

Iodoacetic acid (IAA) is a halogenated disinfection by-product of growing concern due to its high cytotoxicity, genotoxicity, endocrine disruptor effects, and potential carcinogenicity. However, the data on distribution and excretion of IAA after ingestion by mammals are still scarce. Here, we developed a reliable and validated method for detecting IAA in biological specimens (plasma, urine, feces, liver, kidney, and tissues) based on modified QuEChERS sample preparation combined with gas chromatography-tandem triple quadrupole mass spectrometry (GC–MS/MS). The detection method for IAA exhibited satisfactory recovery rates (62.6–108.0%) with low relative standard deviations (RSD < 12.3%) and a low detection limit for all biological matrices ranging from 0.007 to 0.032 ng/g. The study showed that the proposed method was reliable and reproducible for analyzing IAA in biological specimens. It was successfully used to detect IAA levels in biological samples from rats given gavage administration. The results indicated that IAA was found in various tissues and organs, including plasma, thyroid, the liver, the kidney, the spleen, gastrointestinal tract, and others, 6 h after exposure. This study provides the first data on the in vivo distribution in and excretion of IAA by mammals following oral exposure. [ABSTRACT FROM AUTHOR]

Nitrogen-containing disinfection by-products (N-DBPs) produced in the process of drinking water disinfection are widely concerning due to the high cytotoxicity and genotoxicity. It is due to the difficulty of natural degradation of N-DBPs in water and the fact that conventional treatment systems do not effectively treat N-DBPs in drinking water. In this study, N-nitrosopyrrolidine (NPYR) in water was electrocatalytically degraded by a three-dimensional electrode reactor (3DER). This system applied graphite plates as anode and cathode. The granular activated carbon (GAC) was used as third electrode. The degradation of NPYR using a continuous flow three-dimensional electrode reactor was investigated by examining the effects of flow rate, current density, electrolyte concentration, and pollutant concentration on the degradation efficiency, energy consumption, and reaction kinetics of GAC particle electrodes. The results showed that the optimal operating conditions were flow rate = 0.45 mL/min, current density = 6 mA/cm2, Na2SO4 concentration = 0.28 mol/L, and NPYR concentration = 20 mg/L. Under optimal conditions, the degradation of NPYR exceeded 58.84%. The main contributor of indirect oxidation was deduced from free radical quenching experiments. NPYR concentration was measured by GC–MS with DB-5 capillary column, operating in full scan monitoring mode for appropriate quantification of NPYR and intermediates. Based on the identification of reaction intermediates, a possible pathway for the electrochemical oxidation of NPYR on GAC particle electrodes was proposed. [ABSTRACT FROM AUTHOR]

The quality and quantity of dissolved organic matter (DOM) in lakes as well as its environmental effects associated with the unintended disinfection by-products (DBPs) have received continuous attention. This work investigated the spatiotemporal dynamics of DOM in Shengzhong Lake in southwest China and the formed DBPs during the chlorine disinfection process. The results showed that lake water in summer had significantly higher dissolved oxygen and dissolved organic carbon than that in winter. In contrast, DOM in winter demonstrated an obviously higher aromaticity and molecular weight than that in summer. Four fluorescence components, i.e., terrestrial humic-like substances (C1), protein-like substances (C2), and microbial humic-like substances (C3 and C4), were identified, and their relative abundance followed in the order of C3 > C4 > C2 > C1 in winter and C4 > C3 > C1 > C2 in summer. The formation potential of trihalomethanes and haloacetic acids in winter was higher and lower than that in summer, which was mainly ascribed to the content of aromatic and hydrophobic substances. Compared to the significant seasonal dynamic, the spatial variation of DOM and the formed DBPs was not obvious. This work sheds light on the spatial-temporal distribution of DOM and the potentially formed DBPs in Shengzhong Lake, and will be helpful for understanding the biogeochemical cycle of carbon and assessing the drinking water safety. [ABSTRACT FROM AUTHOR]

Pavement engineers are constantly trying to develop correlations between functional and structural indicators to develop best practices for pavement evaluation and make more informative maintenance and repair (M&R) decisions. This study aims to thoroughly investigate the interaction between the International Roughness Index (IRI), a standard index used to quantify the functional properties of a pavement, and various deflection-based parameters (DBPs) used to detect changes in the structural integrity of pavement. To achieve this goal, long-term pavement performance (LTPP) data from two different Pavements A and B are analyzed. The focus is to diagnose roughness problems detected on pavement surfaces by analyzing the predictability of DBPs based on IRI and pavement layer thickness. It is observed that two IRI values are at least needed to properly reflect the pavement profile condition; a median level and an upper level corresponding to the 90th percentile of a subsection's IRI level. For Pavement A, the median IRI is considered a good predictor, with an R2 value of 0.71, of the Surface Curvature Index that reflects the condition of the asphalt layers, whereas for Pavement B, the upper IRI is considered a good predictor, with a lower R2 value of 0.65, of the deflection index that reflects the pavement's substructure condition (i.e., the condition at higher depths). From a practical perspective, the interaction between roughness and individual DBPs can help engineers and practitioners better identify the potential origin depth of roughness problems and optimize pavement condition assessment strategy. [ABSTRACT FROM AUTHOR]

Bromate is receiving increased attention as a typical disinfection by-product in aquatic environments, but bromate toxicity tests on invertebrate such as Brachionus calyciflorus rotifer are inadequate. In the present study, the long-term toxicity tests on B. calyciflorus were performed during 21 days under the exposure of different bromate concentrations and two algal density conditions. Furthermore, we evaluated the feeding behaviors of the rotifers under the impact of bromate. The maximum population density of rotifers was significantly reduced at 100 and 200 mg/L bromate exposure at the two algal density conditions. However, we observed that the maximum population density and population growth rate of rotifers were higher at 3.0 × 106 cells/mL algal density than those at 1.0 × 106 cells/mL under the same conditions of bromate exposure. These results suggest that higher food density may have alleviated the negative effects of bromate on rotifers. Meanwhile, the ingestion rate at an algal density of 3.0 × 106 cells/mL was higher than that at 1.0 × 106 cells/mL. The present study provides a basic reference to comprehensively evaluate the toxic effects of bromate on aquatic organisms. [ABSTRACT FROM AUTHOR]

Laboratory determination of trihalomethanes (THMs) is a very time-consuming task. Therefore, establishing a THMs model using easily obtainable water quality parameters would be very helpful. This study explored the modeling methods of the random forest regression (RFR) model, support vector regression (SVR) model, and Log-linear regression model to predict the concentration of total-trihalomethanes (T-THMs), bromodichloromethane (BDCM), and dibromochloromethane (DBCM), using nine water quality parameters as input variables. The models were developed and tested using a dataset of 175 samples collected from a water treatment plant. The results showed that the RFR model, with the optimal parameter combination, outperformed the Log-linear regression model in predicting the concentration of T-THMs (N25 = 82–88%, rp = 0.70–0.80), while the SVR model performed slightly better than the RFR model in predicting the concentration of BDCM (N25 = 85–98%, rp = 0.70–0.97). The RFR model exhibited superior performance compared to the other two models in predicting the concentration of T-THMs and DBCM. The study concludes that the RFR model is superior overall to the SVR model and Log-linear regression models and could be used to monitor THMs concentration in water supply systems. [ABSTRACT FROM AUTHOR]

Disinfection by-products (DBPs) are a concern due to their presence in chlorinated wastewater, sewage treatment plant discharge, and surface water, and their potential for environmental toxicity. Despite some attention to their ecotoxicity, little is known about the phytotoxicity of DBPs. This study aimed to evaluate the individual and combined phytotoxicity of four trihalomethanes (THMs: trichloromethane (TCM), bromodichloromethane (BDCM), dibromochloromethane (DBCM), and tribromomethane (TBM) and their mixture (THM4)), and trichloroacetic acid (TCAA) using genotoxic and cytotoxic assays. The analysis included seed germination tests using Vigna radiata and root growth tests, mitosis studies, oxidative stress response, chromosomal aberrations (CA), and DNA laddering using Allium cepa. The results showed a progressive increase in root growth inhibition for both plant species as the concentration of DBPs increased. High concentrations of mixtures of four THMs resulted in significant (p < 0.05) antagonistic interactions. The effective concentration (EC50) value for V. radiata was 5655, 3145, 2690, 1465, 3570, and 725 mg/L for TCM, BDCM, DBCM, TBM, THM4, and TCAA, respectively. For A. cepa, the EC50 for the same contaminants was 700, 400, 350, 250, 450, and 105 mg/L, respectively. DBP cytotoxicity was observed through CAs, including C-metaphase, unseparated anaphase, lagging chromosome, sticky metaphase, and bridging. Mitotic depression (MD) increased with dose, reaching up to 54.4% for TCAA (50–500 mg/L). The electrophoresis assay showed DNA fragmentation and shearing, suggesting genotoxicity for some DBPs. The order of phytotoxicity for the tested DBPs was TCAA > TBM > DBCM > BDCM > THM4 > TCM. These findings underscore the need for further research on the phytotoxicity of DBPs, especially given their common use in agricultural practices such as irrigation and the use of sludge as manure. [ABSTRACT FROM AUTHOR]

Water treatment for most public pools involves disinfection with active chlorine leading to the formation of disinfection by-products (DBPs). Among them, nitrogen-containing compounds (N-DBPs) having increased toxicity and adverse effects on human health are of the greatest concern. Being the major component of various body washers for swimmers, cocamidopropyl betaine (CAPB) represents a potential and still underestimated anthropogenic precursor of N-DBPs in pool water. The purpose of this study was to investigate CAPB transformation pathways and mechanisms under the aqueous chlorination conditions. High-performance liquid and two-dimensional gas chromatography hyphenated with high-resolution mass spectrometry were used for the search and tentative identification of the primary and final CAPB transformation products. A wide range of DBPs containing up to five chlorine atoms including these in combination with hydroxyl and additional carbonyl groups has been revealed in model chlorination experiments for the first time. The proposed mechanism of their formation involves nucleophilic substitution of the secondary amide hydrogen atom at the first stage with subsequent free radical and electrophilic addition reactions resulting in non-selective introduction of halogen atoms and hydroxyl groups in the alkyl chain. The deep transformation products include short-chain chlorinated hydrocarbons and their oxidation products as well as dimethylcarbamoyl chloride possessing high toxicity and carcinogenic properties. Targeted analysis of real swimming pool water samples confirmed the results of model experiments enabling semi-quantitative determination of CAPB (0.8 µg L–1) and 18 primary DBPs, including 10 chlorine-containing compounds with the total concentration of 0.1 µg L–1. Among them, monochloro (50%) and hydroxydichloro (25%) derivatives predominate. The toxicity and health of the main DBPs has been estimated using QSAR/QSTR approach. Thus, the possibility of formation of new classes of potentially toxic chlorine-containing DBPs associated with the widespread use of detergents and cosmetics was shown. [ABSTRACT FROM AUTHOR]

The reactions between natural organic matter, anthropogenic contaminants, ions, and disinfectants lead to the formation of disinfection by-products (DBPs) such as trihalomethanes (THMs) in drinking water. The formation of THMs is strongly related to the chlorination of water. The study's central objective was to compare the concentration of THMs in twenty developed and developing countries and their disinfection techniques. The THM concentration in 11 developed and 9 developing countries ranged from 0.5 µg/L (Germany) to 215 µg/L (Russia) and 3 µg/L (China) to 439.2 µg/L (Bangladesh), respectively. The developed country has partially succeeded in reducing THM concentration in drinking water, whereas significant steps are needed in developing countries to reduce the existing high THM concentration. The concentration of THMs in water varies among these countries because of the different water sources, water quality, environmental conditions, and efficiency of water treatment technologies. A meaningful relationship has been observed between the properties of water and the THM formation. The use of chemical disinfectants will result in new forms of DBPs that are undesirable due to their carcinogenic and mutagenic effects on human health. The DBP guidelines by various national and international agencies have helped to control and manage the THM concentration in drinking water. However, these regulatory standards are not continuously monitored. Therefore, the formation of these compounds should be prevented either by removing THMs forming precursors or by using an integrated approach for controlling THM formation by implementing advanced water treatment technology. Extensive research is desirable in domains like THM minimization strategies which are easy to deploy, scalable, and cost-effective. [ABSTRACT FROM AUTHOR]

To assess the water quality characteristics of different types of water sources and find their differences in water quality, quality of drinking water sources including reservoirs, rivers, springs, and groundwater in the lower reaches of Yellow River has been seasonally investigated during 2019 and 2021. The water quality varied greatly among different water bodies, and the four types of water bodies were divided into surface (reservoirs and rivers) and groundwater (groundwater and springs) based on the water quality characteristics. Five principal components were extracted, together explaining 84% of all the variance information by log-transformed principal component analysis, which represented that anions, formation potential of disinfection by-products precursors, nutrients, and phytoplankton biomass affected the water quality of these waterbodies. The matter sources of surface water and groundwater were quite different, with dominant by organic compounds and inorganic matters, respectively. However, the similar humus carbon-to-nitrogen ratio (HS-C/N) values indicated that the organic matter in groundwater is affected to a certain extent by the replenishing surface water. In the aspect of inorganic ions, these waterbodies were more affected by Na+–Cl−–SO42− in the wet season, while Ca2+–HCO3−–CO32− in the dry season. Gibbs diagram suggested that the anions and cations were mainly contributed by atmospheric precipitation for the surface water, while they were mainly derived from rock weathering for the groundwater. It is hoped that this study will help to evaluate the pollution risk and the feasibility of long-term implementation of artificial source remediation projects. [ABSTRACT FROM AUTHOR]

Various advanced treatment processes including ultrafiltration (UF), ozonation, enhanced coagulation, and biological aerated filter (BAF) have been applied to reduce dissolved organic matter (DOM) from the secondary effluent of municipal wastewater treatment plants (MWTPs). In this study, DOM were characterized and the relationship between DOM characteristics and disinfection by-products (DBPs) generation was investigated systematically. Results showed that BAF and ozonation processes could significantly affect DOM characteristics in the treated effluents and the following DBP generation. UF and enhanced coagulation reduced the production of DBPs by removing large molecular hydrophobic organics. The removal of low molecule DOM by BAF resulted in a 67.6% reduction in trihalomethanes (THMs) production. Ozonation could oxidize large hydrophobic DOM into small hydrophilic molecules containing aldehyde and ketone groups, leading to 54% increase of halogenated aldehydes (HALs) and halogenated ketones (HKs). Humic acid (HA) was the main organic type in DOM and important precursor for THMs and dichloroacetonitrile (DCAN) formation. The generation of trichloromethane (TCM) showed a significant positive correlation (R2 = 0.987) with the specific ultraviolet absorbance at 254 nm (SUVA). Large molecule hydrophobic DOM devoted the most to the formation of carbonaceous disinfection by-products and NH 4 + –N content was an important factor affecting the generation of nitrogenous disinfection by-products. These results are important for the optimization of advanced treatment process in MWTPs, and controlling DBPs should consider the removal of low MW hydrophobic DOM and the reduction of SUVA. [ABSTRACT FROM AUTHOR]

Disinfectants and preservatives used as biocides may contain or release active substances (a.s.) that can form by-products with the surrounding matrices during their application which may be released into the environment. Over the past 40 years, several hundred of these so-called disinfection by-products (DBPs) have been detected after applications of biocides used for disinfection. Due to intensive research and further development of analytical capabilities, many new DBP classes, such as iodinated DBPs (I-DBPs), halonitromethanes (HNMs), haloacetamides (HaAms), or halomethanesulfonic acids were detected worldwide in various matrices and applications. Due to the possible hazards and risks for humans and the environment, frequently occurring DBP classes, such as trihalomethanes (THM), haloacetic acids (HAA) and nitrosamines (NDMA), have already been included in many legislations and given limit values. In the European Union, biocides are assessed under the Biocidal Products Regulation 528/2012 (BPR) regarding their efficacy, potential hazards, and risks to human health and the environment. However, the available guidance for the environmental risk assessment (ERA) of DBPs remains vague. To identify knowledge gaps and to further develop the assessment scheme for the ERA of DBPs, a literature search on the multiple uses of biocides and their formation potential of DBPs was performed and the existing process for ERA was evaluated. The results show knowledge gaps on the formation of DBP in non-aqueous systems and DBP formation by non-halogen-based biocidal active substances. Based on the literature research on biocides, a possible proposal of grouping a.s. to consider their DBP formation potential is presented to simplify future ERAs. However, this also requires further research. Until then, a pragmatic approach considering the DBPs formation potential of the active substances and the identified knowledge gaps need to be established for the environmental risk assessment of DBPs in the EU. [ABSTRACT FROM AUTHOR]

Disinfection by-products (DBPs) are formed in the water in swimming pools due to reactions between disinfectants (chlorine, bromine, ozone) and the organic matter introduced by bathers and supply water. High concentrations of DBPs are also reported in the air of indoor swimming pools. Based on a robust multisampling program, the levels and variations of DBPs in the air (trichloramine [TCAM] and trihalomethanes [THMs]) and water (THM) were assessed, as well as their precursors (total organic carbon, water temperature, pH, free, and total chlorine) and proxies (CO2 and relative humidity) in four indoor chlorinated swimming pools. High-frequency sampling was conducted during one high-attendance day for each pool. This study focused on parameters that are easy to measure in order to develop models for predicting levels of THMs and TCAM in the air. The results showed that the number of bathers had an important impact on the levels of THMs and TCAM, with a two-to-three-fold increase in air chloroform (up to 110 μg/m3) and a two-to-four-fold increase in TCAM (up to 0.52 mg/m3) shortly after pools opened. The results of this study for the first time showed that CO2 and relative humidity can serve as proxies for monitoring variations in airborne THMs and TCAM. Our results highlight the good predictive capacity of the developed models and their potential for use in day-to-day monitoring. This could help optimize and control DBPs formation in the air of indoor swimming pools and reduce contaminant exposure for both pool employees and users. [ABSTRACT FROM AUTHOR]

This work presents a collaboration between the so-called Gasset Service Association (responsible for providing drinking water to 100,000 inhabitants from a surface water reservoir) and researchers from the University of Castilla-La Mancha (Spain). The main aim of this work was providing a comprehensive characterization of the formation and removal of disinfection by-products in a real drinking water treatment plant (DWTP) and water distribution network. According to the results obtained, it can be stated that bromate is formed on the pre-oxidation stage and it is not eliminated throughout the DWTP; meanwhile, total organic carbon is partially removed on the clarification process. Moreover, it demonstrates the key role of the residence time and the type of water storage throughout the distribution network (either in pipes or in tanks) due to the combined effect of, at least, four overlapped mechanisms: THMs chemical generation, air stripping, hydrolysis and biological removal. This comprehensive view of the drinking water production and distribution network represents an excellent framework for allowing the improvement in the drinking water quality for a very common water production case study: a medium-size city fed by a surface water source. [ABSTRACT FROM AUTHOR]

Trihalomethanes (THMs) are the first disinfectant by-products in the drinking water distribution network and are classified as potential carcinogens. The presence of THMs in chlorinated water depends on the pH, water temperature, contact time between water and chlorine, type and dose of disinfection, bromide ion concentration, and type and concentration of natural organic materials (NOMs). In the present study, the formation of THMs was evaluated by six simple and easy water quality parameters and modeled by an artificial neural network (ANN) approach through five water distribution networks (WDNs) and the Karoun River in Khuzestan province. The results of this study that was conducted from October 2014 to September 2015 showed that THM concentration ranged in five WDNs, including Shoushtar, Ahvaz (2), Ahvaz (3), Mahshahr, Khorramshahr, and total WDNs through N.D.–9.39 µg/L, 7.12–28.60, 38.16–67.00, 17.15–90.46, 15.14–29.99, and N.D.–156, respectively. The concentration of THMs exceeded Iran and EPA standards in many cases in Mahshahr and Khorramshahr WDNs. Evaluation of R2, MSE, and RMSE showed the appropriate correlation between measured and modeled THMs, indicating a reasonable ANN potential for estimating THM formation in water sources. [ABSTRACT FROM AUTHOR]

Parabens are ubiquitous, being found in surface waters around the world. Although little is known about the release of paraben transformation products and fate of transformation products in surface water. This study evaluates both parabens and paraben transformation products in the Brazos River upstream and downstream of a wastewater facility located in Waco, Texas. Concentrations of thirteen compounds were reported in this study, five parent parabens and eight paraben disinfection by-products. Analyte concentrations were spatially evaluated to determine if release of wastewater effluent affects their concentrations in the river. Two Brazos River tributaries were also sampled to determine if they released parabens and related compounds to the Brazos. Sampling occurred weekly for one year with at least 40 samples collected at each site. Analyses were completed for both yearly and seasonal data. Sites downstream of wastewater treatment outfalls had lower concentrations of methyl paraben during the yearly analysis and across multiple seasons in the seasonal analysis with average yearly annual methyl paraben concentrations decreasing from 0.83 ng/L at site 3 to 0.09 ng/L at site 4. Para-hydroxybenzoic acid was the compound present in greatest concentration at most sites across most seasons, with the highest average annual concentration of 10.30 ng/L at site 2. Spatial changes in para-hydroxybenzoic acid varied by season, with seasonal trends only identifiable after normalization by flow. Dichlorinated paraben concentrations increased in the river at sites downstream of wastewater treatment with a yearly average dichlorinated methyl paraben concentration of 0.490 ng/L at site 3 to 1.53 at site 4, just downstream of the major wastewater treatment plant. Concentration increases indicate that wastewater effluent contains sufficiently high dichlorinated paraben concentrations to effect concentrations downstream of effluent discharges. Dichlorinated species also persisted in the environment, with no significant decreases at sites further downstream during any season with an annual average dichlorinated methyl paraben concentration of 1.23 ng/L at site 6. Methyl paraben concentrations decreased at the site furthest downstream to a concentration of 0.081 ng/L, while dichlorinated methyl paraben concentrations remained stable with a concentration of 1.10 ng/L at the site furthest downstream. Due to the dichlorinated species being released in higher concentrations in effluent than parents and being more resistant to degradation, the dichlorinated parabens are more likely to be environmentally relevant than are parent parabens. [ABSTRACT FROM AUTHOR]

Haloacetonitriles (HANs) are hazardous water disinfection by-products due to their adverse health effects. In this study, the interaction and adsorption of the key HAN pollutants on the fullerene C20 surface were investigated by density functional theory (DFT). Thus, the pristine structures of fullerene, four HANs, and their complexes were geometrically optimized at the B3LYP/6-31G* level of theory with the help of ORCA software package. Natural bond orbital (NBO) results indicate that interaction between the surface of the C20 adsorbent and adsorbate could be chemical in nature. Infrared (IR) frequency computations exhibited that the studied structures are experimentally feasible showing no imaginary frequency. The HANs adsorbed on the surface of C20 confer a greater dipole moment than corresponding unabsorbed compounds. The adsorption energy, Gibbs free energy (ΔGad), and enthalpy (ΔHad) values revealed that the adsorption of HANs on the fullerene C20 surface is exothermic, spontaneous, and irreversible. The calculated chemical potential values are negative for all structures affirming that the scrutinized structures are thermodynamically stable. The increasing trend of adsorption efficiency for fullerene-HANs complexes is C2HBr2N―C20 > C2HBrClN―C20 > C2HCl2N―C20 > CCl3CN―C20. The results demonstrate that fullerene C20 is a proficient adsorbent in removing of HAN contaminants from aqueous media. Besides, C20 provides a proper sensing capability during adsorption due to its increased specific heat capacity and decreased bandgap. To verify the adsorption behavior of considered fullerene, other significant properties such as band gap, chemical hardness, electrophilicity, chemical potential, and charge capacity were also discussed in detail. The molecular electrostatic potential surface (ESP) of haloacetonitriles (HANs), by-products of water disinfection, fullerene C20 adsorbent, and HANs―C20 complexes in aqueous phase using DFT approach [ABSTRACT FROM AUTHOR]

2,5-Dichloro-1,4-benzenediol (2,5-DCBQ) is a putative disinfection by-product that belongs to the halogenated benzoquinone class. However, its developmental toxicity and related mechanism remained unclarified. In our study, we used zebrafish embryos as the model and exposed them to graded concentrations of 2,5-DCBQ (100, 200, 300, 400 μg/L). We found that the rate of epiboly abnormalities increased significantly in a concentration-dependent manner. The results of whole-mount in situ hybridization (WISH) indicated that the expression patterns and levels of chordin (dorsoventral marker), foxa2 (endodermal marker), eve1 (ventral mesodermal marker), and foxb1a (ectodermal marker) were altered, suggesting that 2,5-DCBQ might affect the germ layer development of zebrafish embryos. Integrated transcriptomic and metabolomic analyses were adopted to explore the molecular mechanisms of embryonic developmental delays. The results showed that 2,5-DCBQ exposure induced 1163 differentially expressed genes (DEGs) and 37 differential metabolites (DEMs). Bioinformatic analysis enriched the most affected molecular pathways (Wnt signaling pathway, cell adhesion molecules, actin cytoskeleton regulation) and metabolic pathways (purine metabolism, aminoacyl-tRNA biosynthesis, arginine and proline metabolism) in zebrafish embryos. To summarize, our findings broadened the molecular mechanisms of 2,5-DCBQ embryotoxicity through multi-omics and bioinformatic analyses. [ABSTRACT FROM AUTHOR]

Seawater desalination is practiced in many coastal countries, which is accepted as clean water by the general populations. The untreated seawater reported high concentrations of bromide (50,000 – 80,000 µg/L) and iodide (21 – 60 µg/L) ions, which are reduced to non-detectable levels during thermal desalination while the concentrations of bromide and iodide ions were reduced to 250–600 µg/L and < 4–16 µg/L, respectively during reverse osmosis processes. During the treatment and/or disinfection, many brominated and iodinated disinfection byproducts (Br-DBPs and I-DBPs) are formed in desalinated water, some of which are genotoxic and cytotoxic to the mammalian cells and possible/probable human carcinogens. In this paper, DBPs' formation in desalinated and blended water from source to tap, toxicity to the mammalian cells, their risks to humans and the strategies to control DBPs were investigated. The lifetime excess cancer risks from groundwater, and desalinated and blended water sourced DBPs were 4.15 × 10–6 (4.72 × 10–7 – 1.30 × 10–5), 1.75 × 10–5 (2.58 × 10–6 – 5.25 × 10–5) and 2.59 × 10–5 (4.02 × 10–6 – 8.35 × 10–5) respectively, indicating higher risks from desalinated and blended water (2.56 and 4.51 times respectively) than groundwater systems. Few emerging DBPs in desalinated/blended water showed higher cyto- and genotoxicity in the mammalian cells. The findings were compared with safe drinking water standards and strategies to produce cleaner desalinated water were demonstrated. [ABSTRACT FROM AUTHOR]

While it is known that exposure to disinfection by-products (DBPs), including trihalomethanes (THMs), impairs liver function, few epidemiological studies have explored this association. Here, we determined the concentrations of four urinary trihalomethanes (chloroform [TCM], and three Br-THMs, bromodichloromethane [BDCM], dibromochloromethane [DBCM], and bromoform [TBM]), and nine serum liver function indicators in 182 adults ≥ 18 years of age, examined at a medical examination center in Wuxi, China, in 2020 and 2021. Generalized linear model analysis revealed positive associations between urinary DBCM and alanine aminotransferase (ALT), aspartate aminotransferase (AST), total bilirubin (TBIL), total protein (TP), and albumin (ALB). Urinary Br-THMs and total THMs (TTHMs) were positively associated with ALT, AST, TBIL, indirect bilirubin (IBIL), TP, and ALB (all P < 0.05). Urinary THMs were not associated with alkaline phosphatase (ALP) or glutamine transaminase (GGT) (all P > 0.05). Generalized additive model–based penalized regression splines were used to confirm these associations. In conclusion, THM exposure was associated with altered serum biomarkers of liver function. [ABSTRACT FROM AUTHOR]

The hydrophilic substances in natural organic matter (NOM) are the main precursor of disinfection by-products (DBPs) formed during disinfection processes. The fractionation of the components in NOM based on hydrophilicity contributes to elaborating the behavior of NOM during disinfection. However, the traditional NOM fractionation method using two hydrophobic resins of DAX-8 and XAD-4 lays emphasis on the separation of hydrophobic substances, limiting the thorough study of the hydrophilic components in NOM. In this work, the amphiphilic resin NDAM was employed as a replacement of XAD-4 to realize more thorough separation of the hydrophilic substances. Compared with the divinylbenzene (DVB) structure of XAD-4, the NDAM possesses a more hydrophilic skeleton of N-vinylpyrrolidone (NVP) and DVB which favors the adsorption of hydrophilic components in NOM. The two fractionation methods of DAX-8 + XAD-4 and DAX-8 + NDAM were applied to fractionate NOM, and the obtained fractions were characterized via fluorescence spectra, UV spectra, acid–base titration, the partition coefficients of aqueous two-phase systems(ATPs), and 1H nuclear magnetic resonance (1H-NMR). The results showed that the transphilic fractions separated by XAD-4 accounted for 11.09% of NOM, while the proportion increased to 20.33% with the method of NDAM fractionation. Besides, the hydrophilic components enriched by NDAM not only have more π-conjugated systems and more aromatic structure but also contain more oxygen-containing and nitrogen-containing functional groups. In addition, the hydrophilic fractions separated by NDAM contained more DBP precursors. The NDAM separates more NOM which can produce bromine-containing DBPs into HPIA, and the DBP productivity of HPIN is significantly higher than that of XAD-4. In general, the NOM fractionation method proposed in this study utilizing NDAM resin could fractionate the hydrophilic fractions in NOM more thoroughly, showing application potential in the analysis and control of DBPs formed from NOM. [ABSTRACT FROM AUTHOR]

Hydrothermal liquefaction (HTL) is an emerging method for thermochemical conversion of wet organic waste and biomass into renewable biocrude. HTL also produces an aqueous phase (HTL-AP) side stream containing 2–4% light organic compounds that require treatment. Although anaerobic digestion (AD) of HTL-AP has shown promise, lengthy time periods were required for AD microbial communities to adapt to metabolic inhibitors in HTL-AP. An alternative for HTL-AP valorization was recently demonstrated using two engineered strains of Yarrowia lipolytica, E26 and Diploid TAL, for the overproduction of lipids and the polyketide triacetic acid lactone (TAL) respectively. These strains tolerated up to 10% HTL-AP (v/v) in defined media and up to 25% (v/v) HTL-AP in rich media. In this work, adaptive laboratory evolution (ALE) of these strains increased the bulk population tolerance for HTL-AP to up to 30% (v/v) in defined media and up to 35% (v/v) for individual isolates in rich media. The predominate organic acids within HTL-AP (acetic, butyric, and propionic) were rapidly consumed by the evolved Y. lipolytica strains. A TAL-producing isolate (strain 144-3) achieved a nearly 3-fold increase in TAL titer over the parent strain while simultaneously reducing the chemical oxygen demand (COD) of HTL-AP containing media. Fermentation with HTL-AP as the sole nutrient source demonstrated direct conversion of waste into TAL at 10% theoretical yield. Potential genetic mutations of evolved TAL production strains that could be imparting tolerance were explored. This work advances the potential of Y. lipolytica to biologically treat and simultaneously extract value from HTL wastewater. Key points: • Adaptive evolution of two Y. lipolytica strains enhanced their tolerance to waste. • Y. lipolytica reduces chemical oxygen demand in media containing waste. • Y. lipolytica can produce triacetic acid lactone directly from wastewater. [ABSTRACT FROM AUTHOR]

Trihalomethanes (THMs) are common disinfection by-products in chlorinated tap waters. They can cause various cancers and non-cancer health hazards. Ingestion, dermal contact, and inhalation are the three exposure routes considered in the THM hazard or risk assessments. Among these, inhalation hazard is generally calculated by assuming the initial concentration as zero. This assumption fails to address the case of continuous or successive showers that can happen in shared showering facilities such as student hostels or gymnasiums. In the present study, the leftover THM concentration from the previous bath was considered to assess the chronic daily intakes (CDI) and hazard index (HI) for successive showers. For this, tap water of a university campus was analyzed to understand the extent of THM exposure at consumer points and the result obtained was used for the hazard assessment. Total THM concentrations varied from 0.51 to 68.9 µg L−1. To address the variability of the model input parameters, 50,000 iterations of Monte Carlo simulation were carried out. Maximum HI values of 7.94E − 02 ± 3.63E − 02, and 6.69E − 02 ± 3.08E-02 were observed for the 1st shower for females and males, respectively. This value increased exponentially up to the 5th shower and thereafter, the value was constant. The methodology followed in the present study successfully determines the risk and hazard of THMs through successive showers. [ABSTRACT FROM AUTHOR]

Biological activated carbon (BAC) will produce soluble microbial products (SMPs), which affect effluent quality. To clarify the mechanism by which BAC affects effluent water quality, the processes of a drinking water plant in Jiangsu Province were investigated. It was found that during the O3-BAC process, although ozonation could remove dissolved organic matter (DOC) to a certain extent, the DOC increased from 4.44 to 4.47 mg/L after BAC. Dissolved organic matter (DOM) in effluent from different processes was divided into five fractions based on hydrophilicity and hydrophobicity by resin fractionation. Through fluorescence excitation-emission matrix (EEM) spectroscopy combined with DOC analysis, it was found that SMPs are mainly included in transitional hydrophilic neutral (TPIN) fraction, which was the main cause of the DOC increase. Therefore, a new combined process was designed to remove TPIN effectively by coagulation after biological treatment, and found that coagulation had a good removal rate (13.2%) on TPIN. The trihalomethane formation potential (THMFP) of TPIN could be reduced effectively by 44.9% after coagulation. Compared with the old process, the new combined process had a higher removal rate (14.2–30.0%) of DOC, as well as a greater reduction of THMFP (29.0–78.6%) and haloacetic acid formation potential (HAAFP) (46.4–75.3%). This study aims to reveal the mechanism by which SMPs affect effluent water quality and exacerbate health risks, and to propose a solution to provide theoretical support for the design and optimization of drinking water treatment processes. [ABSTRACT FROM AUTHOR]

Trihalomethanes (THMs) are the most common species of disinfection by-products (DBPs) in swimming pools and have received widespread attention due to their risk to public health. However, studies examining within-day variation and the carcinogenic health risks from exposure to THMs in indoor swimming pools are limited. Our study aimed to detect the within-day variation of four THMs categories and carcinogenic health risk in indoor swimming pool water in Taiyuan, China, and to examine the correlations between THMs and environmental parameters. Our results showed chloroform (TCM) was the most abundant component in THMs with median concentrations from 0.038–0.118 μg/m3. TCM and THMs were significantly positively correlated with FCl and significantly negatively correlated with the cumulative number of swimmers (CNS) in the swimming pool. The concentration of total THMs and TCM, lifetime average daily doses (LADD) of TCM, and the total lifetime cancer risks (ELCR) values of THMs declined with time with the highest level occurring at 8:00 am. ELCR values of THMs were in the range of 1.368 × 10−5–1.968 × 10−5, which exceeded the negligible risk level (10−6) defined by US EPA. Our results suggest that THM occurrence and the carcinogenic health risks in pool water varied temporally. Exposure to pool water THMs may pose a carcinogenic risk to human health, especially at the pool's opening time. [ABSTRACT FROM AUTHOR]

The algal organic matter (AOM) is a problem in water treatment. Although the adsorption process is extensively applied to drinking water treatment, little information is known about the potential of new adsorbents to remove AOM. Herein, this work evaluated the removal of AOM and its main compounds (dissolved organic carbon (DOC), carbohydrate, and protein) by new adsorbents—mesoporous silica (SBA-16), graphene oxide material from citric acid (CA), and sugar (SU), and a composite of CA immobilized on sand (GSC). In general, the removal efficiencies followed the order of SBA-16 > CA > SU or GSC for DOC, carbohydrate, and protein. At environmental condition (5 mg DOC·L−1 and pH 8), high removals were reported for SBA-16 (88.8% DOC, 80.0% carbohydrate, and 99.6% protein) and CA (70.0% DOC, 66.7% carbohydrate, and 89.7% protein), while moderate removals were found for SU (60.5% DOC, 47.9% carbohydrate, and 66.5% protein) and GSC (67.4% DOC, 60.8% carbohydrate, and 57.4% protein). Based on these results, further analyses were done with SBA-16 and CA. Both adsorbents' efficiencies decayed with the pH increment of the test water. Disinfection by-products reductions found using SBA-16 — trihalomethanes (58.2 to 94.7%) and chloral hydrate (48.7 to 78.8%) — were higher than the ones using CA—trihalomethanes (45.2 to 82.4%) and chloral hydrate (40.1 to 70.8%). This study showed the potential of applying these adsorbents for AOM removal, and further investigations are suggested to increase the adsorption capacity of these adsorbents. [ABSTRACT FROM AUTHOR]

Benzalkonium salts are widely used in the composition of antimicrobial preparations in industry and everyday life and as algaecides to treat pool water. The disinfection of tap or waste water with active chlorine in the presence of natural or anthropogenic bromide anions or using bromine as a pool water disinfectant creates conditions for the interaction of benzalkonium cations with active bromine to form disinfection by-products. This study presents the results of a model benzalkonium bromination with the identification of the resulting products by high-performance liquid and gas chromatography combined with high-resolution mass spectrometry. The primary transformation products are monobromo derivatives formed by the radical substitution of hydrogen atoms of the alkyl chain with bromine. Their further transformations yield dibromo-, hydroxy-, and hydroxybromo derivatives. The final products of the deep degradation of benzalkonium are bromoform, bromoacetonitrile, and several brominated hydrocarbons. [ABSTRACT FROM AUTHOR]

The purity of drinking water is an important issue of the human life quality. Water disinfection has saved millions people from the diseases spread with water. However, that procedure has a certain drawback due to formation of toxic organic disinfection products. Establishing the structures of these products and the mechanisms of their formation and diminishing their levels in drinking water represent an important task for chemistry and medicine, while mass spectrometry is the most efficient tool for the corresponding studies. The current review throws light upon natural and anthropogenic sources of the formation of disinfection by-products (DBPs) and the mechanisms of their formation related to the structural peculiarities and the presence of functional groups. In addition to chlorination, bromination is discussed since it is used quite often as an alternative method of disinfection, particularly, for the purification of swimming pool water. The benefits of the contemporary GC/MS and LC/MS methods for the elucidation of DBP structures and study of the mechanisms of their formation are discussed. The reactions characteristic for various functional groups and directions of transformation of certain classes of organic compounds in conditions of aqueous chlorination/bromination are also covered in the review. [ABSTRACT FROM AUTHOR]

During disinfection of drinking water, natural organic matter reacts with chlorine to produce harmful disinfection by-products. The identification of precursors of disinfection by-products in natural organic matter is challenging because natural organic matter is very complex and poorly known. Therefore, scientists have focused on the fractionation of natural organic matter with membranes or resins to better understand how and which organic matter fractions react during chlorination. Here, we compared the reactivity of various organic fractions with disinfection by-products. For that we did a meta-analysis of 400 water samples published in 80 publications, with focus on chlorination time and dose, SUVA254 and the column capacity factor used during resin fractionation. SUVA254 refers to the ultraviolet absorbance at 254 nm divided by the organic matter concentration. We found that hydrophobic compounds have 10–20% higher reactivity to both trihalomethane and haloacetic acid formation compared to hydrophilic compounds in waters with SUVA254 above 2L/(mg∙m), while hydrophobic and hydrophilic compounds have equal reactivity in waters with low SUVA254. On the other hand, hydrophilic compounds are 20–80% more reactive towards emerging disinfection by-products, regardless of SUVA254. Chlorination time and dose do not influence the reactivity ratio between the different fractions. An increase in column capacity factor can shift the reactivity ratio from hydrophobic to hydrophilic fractions. Dead-end, stirred cell ultrafiltration membrane fractionation might not always produce sharply separated fractions, which is mainly due to fouling. Therefore, no clear correlation could be found between membrane fractions and all investigated disinfection by-product groups. [ABSTRACT FROM AUTHOR]

Introduction: The 2,6-dichloro-1,4-benzoquinone (DCBQ) and its derivative 2,6-dichloro-3-hydroxy-1,4-benzoquinone (DCBQ-OH) are disinfection by-products (DBPs) and emerging pollutants in the environment. They are considered to be of particular importance as they have a high potential of toxicity and they are likely to be carcinogenic. Objectives: In this study, human epidermal keratinocyte cells (HaCaT) were exposed to the DCBQ and its derivative DCBQ-OH, at concentrations equivalent to their IC20 and IC50, and a study of the metabolic phenotype of cells was performed. Methods: The perturbations induced in cellular metabolites and their relative content were screened and evaluated through a metabolomic study, using 1H-NMR and MS spectroscopy. Results: Changes in the metabolic pathways of HaCaT at concentrations corresponding to IC20 and IC50 of DCBQ-OH involved the activation of cell membrane α-linolenic acid, biotin, and glutathione and deactivation of glycolysis/gluconeogenesis at IC50. The changes in metabolic pathways at IC20 and IC50 of DCBQ were associated with the activation of inositol phosphate, pertaining to the transfer of messages from the receptors of the membrane to the interior as well as with riboflavin. Deactivation of biotin metabolism was recorded, among others. The cells exposed to DCBQ exhibited a concentration-dependent decrease in saccharide concentrations. The concentration of steroids increased when cells were exposed to IC20 and decreased at IC50. Although both chemical factors stressed the cells, DCBQ led to the activation of transporting messages through phosphorylated derivatives of inositol. Conclusion: Our findings provided insights into the impact of the two DBPs on human keratinocytes. Both chemical factors induced energy production perturbations, oxidative stress, and membrane damage. [ABSTRACT FROM AUTHOR]

Algal organic matter (AOM) in water reservoirs is a worldwide concern for drinking water treatment, once it is one of the main precursors for disinfection by-product formation. Oxidative processes have been widely applied in drinking water treatment to improve microalgae removal; however, there is little information about their performance for AOM degradation. In this context, this study aimed to evaluate the performance of hydrogen peroxide (H2O2), Fenton (H2O2/Fe(II)), and photo-Fenton (H2O2/Fe(II)/UV) processes for AOM removal. Low AOM removals (0.46 to 12.02%) were found using H2O2. The highest AOM removals for H2O2/Fe(II) (29.8%) and H2O2/Fe(II)/UV (67.0%) were obtained using 40 and 30 mg Fe∙L−1 at 150 min, respectively. In general, high pH values decreased AOM removals for H2O2/Fe(II) and H2O2/Fe(II)/UV processes and increased them for H2O2 application. All oxidative processes had stabilized at 150 min, and further reaction time did not significantly increase the AOM removal. Trihalomethane formation potential (THMFP) was evaluated using the optimal conditions of each process. Reductions of THMFP were 42.0, 74.0, and 83.4% for H2O2, H2O2/Fe(II), and H2O2/Fe(II)/UV, respectively. This study showed the potential of oxidative processes to complement AOM removal by the traditional technologies applied in water treatment. Further studies are required to optimize the parameters involved in the process to improve the cost-effectiveness of the processes and applicability in water treatment. [ABSTRACT FROM AUTHOR]

Since the early twentieth century, disinfecting water has been an essential process to prevent the introduction of harmful organisms, especially pathogenic organisms. Due to the reaction between anthropogenic contaminants present in water and the chemicals used to disinfect water, compounds known as disinfection by-products (DBPs) are formed during the water disinfection process. Chlorination, the most dominant water disinfection method, produces DBPs that have drawn a lot of attention and health concerns. The most commonly used removal technology for trichloromethane (TCM) is adsorption, and the use of activated carbon, iron oxides, and nanoparticles has been widely investigated. Studies have found that using nano-zero valent iron with nano-catalytic metals (Cu, Ni etc.) to synthesize bimetallic nanoparticles increases the removal of organic pollutants. The current study investigates the adsorption of trichloromethane (TCM) by synthesized Fe/Cu bimetallic nanoparticles. The response surface methodology (RSM) was used to investigate the effect of independent variables on the removal of TCM. According to the CCD results, TCM concentration and reaction time were determined as the most effective parameters. The lowest TCM concentrations have low removal efficiencies, while the lowest TCM concentration (50 µg/L) can be removed up to 60%. The highest TCM concentration can be 500 µg/L to achieve a removal below the limits with 500 mg/L Fe/Cu concentration and 24 min of reaction time. Life cycle assessment (LCA) was applied to Fe/Cu nanoparticle synthesis, and results indicated that the highest environmental impact was from the mixture of reactant stage. [ABSTRACT FROM AUTHOR]

Bromate, classified as a EU CLP 1B carcinogen, is a typical by-product of the disinfection of drinking and swimming pool water. The aim of this study was (a) to provide data on the occurrence of bromate in pool water, (b) to re-evaluate the carcinogenic MOA of bromate in the light of existing data, (c) to assess the possible exposure to bromate via swimming pool water and (d) to inform the derivation of cancer risk-related bromate concentrations in swimming pool water. Measurements from monitoring analysis of 229 samples showed bromate concentrations in seawater pools up to 34 mg/L. A comprehensive non-systematic literature search was done and the quality of the studies on genotoxicity and carcinogenicity was assessed by Klimisch criteria (Klimisch et al., Regul Toxicol Pharmacol 25:1–5, 1997) and SciRAP tool (Beronius et al., J Appl Toxicol, 38:1460–1470, 2018) respectively. Benchmark dose (BMD) modeling was performed using the modeling average mode in BMDS 3.1 and PROAST 66.40, 67 and 69 (human cancer BMDL10; EFSA 2017). For exposure assessment, data from a wide range of sources were evaluated for their reliability. Different target groups (infants/toddlers, children and adults) and exposure scenarios (recreational, sport-active swimmers, top athletes) were considered for oral, inhalation and dermal exposure. Exposure was calculated according to the frequency of swimming events and duration in water. For illustration, cancer risk-related bromate concentrations in pool water were calculated for different target groups, taking into account their exposure using the hBMDL10 and a cancer risk of 1 in 100,000. Convincing evidence was obtained from a multitude of studies that bromate induces oxidative DNA damage and acts as a clastogen in vitro and in vivo. Since statistical modeling of the available genotoxicity data is compatible with both linear as well as non-linear dose–response relationships, bromate should be conservatively considered to be a non-threshold carcinogen. BMD modeling with model averaging for renal cancer studies (Kurokawa et al., J Natl. Cancer Inst, 1983 and 1986a; DeAngelo et al., Toxicol Pathol 26:587–594, 1998) resulted in a median hBMDL10 of 0.65 mg bromate/kg body weight (bw) per day. Evaluation of different age and activity groups revealed that top athletes had the highest exposure, followed by sport-active children, sport-active adults, infants and toddlers, children and adults. The predominant route of exposure was oral (73–98%) by swallowing water, followed by the dermal route (2–27%), while the inhalation route was insignificant (< 0.5%). Accepting the same risk level for all population groups resulted in different guidance values due to the large variation in exposure. For example, for an additional risk of 1 in 100,000, the bromate concentrations would range between 0.011 for top athletes, 0.015 for sport-active children and 2.1 mg/L for adults. In conclusion, the present study shows that health risks due to bromate exposure by swimming pool water cannot be excluded and that large differences in risk exist depending on the individual swimming habits and water concentrations. [ABSTRACT FROM AUTHOR]

Due to the high cost of DNA-binding proteins (DBPs) detection, many machine learning algorithms (ML) have been utilized to large-scale process and detect DBPs. The previous methods took no count of the processing of noise samples. In this study, a fuzzy twin support vector machine (FTWSVM) is employed to detect DBPs. First, multiple types of protein sequence features are formed into kernel matrices; Then, multiple kernel learning (MKL) algorithm is utilized to linear combine multiple kernels; next, self-representation-based membership function is utilized to estimate membership value (weight) of each training sample; finally, we feed the integrated kernel matrix and membership values into the FTWSVM-SR model for training and testing. On comparison with other predictive models, FTWSVM based on SR (FTWSVM-SR) obtains the best performance of Matthew's correlation coefficient (MCC): 0.7410 and 0.5909 on two independent testing sets (PDB186 and PDB2272 datasets), respectively. The results confirm that our method can be an effective DBPs detection tool. Before the biochemical experiment, our model can screen and analyze DBPs on a large scale. [ABSTRACT FROM AUTHOR]

Algal organic matter (AOM) in water reservoirs is a worldwide concern for drinking water treatment; once it is one of the main precursors for disinfection by-products formation (DBPs). In this context, this study investigated the ecotoxicity of DBPs from chlorination of AOM to Ceriodaphnia silvestrii and Daphnia similis (Crustacea, Cladocera). The bioassays evaluated three scenarios, including the AOM extracted from Chlorella sorokiniana, the quenching condition used in the tests, and the DBPs formed after the chlorination of the two test waters with AOM (with and without bromide presence). The results showed that AOM has no toxic effects for the tested species under typical environmental concentration (5 mg∙L−1). However, since AOM is a potential precursor of DBPs, the toxicity of two test waters (TW-1 and TW-2) after the chlorination process (25 mg Cl2·L−1, for 7 days, at 20 °C) was tested. The sample with higher toxicity to the tested species was TW-1, in which chloroform and chloral hydrate were quantified (615 and 267 µg∙L−1, respectively). However, TW-2 showed lower concentration of chloroform and chloral hydrate (260 and 157 µg∙L−1, respectively), although bromodichloromethane, dibromochloromethane, and bromoform were also detected (464, 366, and 141 µg∙L−1, respectively). Although free chlorine is highly toxic to the tested species, the quenching conditions also affected the organisms' survival due to the use of ascorbic acid and the presence of reaction intermediates. Nonetheless, both species were more affected by TW-1 and TW-2 than the quenching condition. These results endorse the importance of removing the AOM before the disinfection process to avoid the formation of DBPs. In addition, ecotoxicological analyses could provide a more comprehensive assessment of water quality, especially considering the challenges of quantifying DBPs and other emerging contaminants. Highlights: • Algal organic matter (AOM) is a precursor of DBPs in chlorinated water. • Environmental concentrations of AOM did not show toxicity to the two species. • The quenching condition of free chlorine using ascorbic acid was toxic. • Chlorination of AOM formed DBPs concentrations toxic to the cladocerans. • Among the five detected DBPs, chlorinated species were more toxic than brominated. [ABSTRACT FROM AUTHOR]

Chlorination is one of the most important stages in the treatment of drinking water due to its effectiveness in the inactivation of pathogenic organisms. However, the reaction between chlorine and natural organic matter (NOM) generates harmful disinfection by-products (DBPs), such as trihalomethanes (THMs). In this research, drinking water quality data was collected from the distribution networks of 19 rural and semi-urban systems that use water sources as springs, surfaces, and a mixture of both, in three provinces of Costa Rica from April 2018 to September 2019. Twelve models were developed from four data sets: all water sources, spring, surface, and a mixture of spring and surface waters. Linear, logarithmic, and exponential multivariate regression models were developed for each data set to predict the concentration of total trihalomethanes (TTHMs) in the distribution networks. Concentrations of TTHMs were found between < 0.20 and 91.31 µg/L, with chloroform being the dominant species accounting for 62% of TTHMs on average. Turbidity, free residual chlorine, total organic carbon (TOC), dissolved organic carbon (DOC), and ultraviolet absorbance at 254 nm (UV254) showed a significant correlation with TTHMs. In all the data sets the linear models presented the best goodness-of-fit and were moderately robust. Four models, the best of each data set, were validated with data from the same systems, and, according to the criteria of R2, standard error (SE), mean square error (MSE), and mean absolute error (MAE), spring water and mixed spring/surface water models showed a satisfactory level of explanation of the variability of the data. Moreover, the models seem to better predict TTHM concentrations below 30 µg/L. These models were satisfactory and could be useful for decision-making in drinking water supply systems. [ABSTRACT FROM AUTHOR]

In this study, a composite biosorbent of zein/ethylene diamine tetraacetic acid/chlorophyll/nano-clay (Ze/EDTA/Chl/Clay) was prepared. Thickness, mechanical properties (tensile strength and strength to breaking point), ability to reduce water hardness, water solubility, water absorption, antioxidant activity and moisture content of prepared biosorbent were studied. SEM, FTIR, XRD and TGA techniques were used to investigate the physicochemical properties and structure of the prepared biosorbent. Optimal biosorbent was selected using statistical methods and used to remove chemical contaminants from industrial wastewater in Urmia (Iran). For this purpose, total heavy metals (THM), total hardness, nitrate, nitrite, COD and BOD, TDS and salinity of industrial wastewater before and after biosorbent treatment were investigated. The results confirmed the homogeneous and cohesive structure of different zein adsorbents. FTIR results showed physical and electrostatic interactions between composite components. Nanoclay increased the thermal stability of the biosorbent. Chlorophyll and EDTA increased the biosorbent ability to absorb water and reduce the total hardness of the water. Clay nanoparticles increased the tensile strength of the biosorbent and chlorophyll and EDTA increased the biosorbent ductility. Under optimal wastewater treatment conditions, Ze/EDTA/Chl/Clay biosorbent was recognized as the best adsorbent. The use of ultrasound in wastewater treatment had a good effect. Under optimal conditions, 57.5% of THM and 67% of nitrate were removed from the wastewater. By comparing the ability of chlorophyll-containing biosorbents (Ze/Chl and Ze/EDTA/Chl/Clay) to remove nitrite and nitrate, it was found that these biosorbents have a very high selectivity in nitrate removal compared to nitrite. [ABSTRACT FROM AUTHOR]

This paper describes an analytical approach based on solid-phase extraction (SPE) followed by analysis using liquid and gas chromatography coupled to mass spectrometry detectors for a determination of 18 organic UV filters from water samples. Extraction method parameters were optimized: 250 ml of water sample loaded on Chromabond C18 cartridges after adjustment to pH 4 and then eluted with acetonitrile. The mobile phase and the parameters of the mass spectrometer, as well as those of the ionization source, were tested to enhance detection sensitivity. During method validation, the extracted target compounds showed good recoveries (> 68%) with acceptable values in terms of repeatability (RSDr) and reproducibility (RSDR), where relative standard deviations values were lower than 20%. The validated method was applied to 10 water samples collected from different swimming pools located in Lebanon from which eight UV filters among the eighteen targets compounds were detected at concentrations ranged between 1 and 2526 µg L−1. The most detected compounds were padimate-O (OD-PABA) and octocrylene (OCR). This study represents the first available data on the occurrence of UV filter residues in Lebanese swimming pool opening hence future perspectives and insights to evaluate their degradation by-products and their toxicity on human health and marine ecosystem. [ABSTRACT FROM AUTHOR]

Extracellular organic matter (EOM) is an important precursor of disinfection by-products (DBPs). Nowadays, little is known about changes in molecular weight (MW) and hydrophilic (HPI)/hydrophobic (HPO) fractions of EOM during the entire algal growth phase. In this study, a combined approach of fractionation procedure and parallel factor (PARAFAC) analysis was applied to characterize the EOM during the entire growth phase of two algal species (M. aeruginosa and Synedra sp.), and investigated the relationships between fluorescent component and the DBP formation potential (FP) in MW and HPI/HPO fractions. Thereinto, three components (including one protein-like component (C1), one humic-like component (C2), and one fulvic acid–like component (C3)) were identified by the PARAFAC model. For two algae, the HPI and high MW (> 100 kDa) fractions were both the main components of algal EOM in the three growth phases in terms of the dissolved organic carbon. The high MW fraction had more C1 compared with other MW fractions, especially for M. aeruginosa. Besides, the formation risk of EOM-derived DBPs from M. aeruginosa was lower than that from Synedra sp. The result of this study showed the FP of DBPs varied with fluorescent components of algal EOM fractions and also indicated that the humic-like substances were tended to form trichloromethane and the tryptophan-like substances were associated with dichloroacetic acid by canonical correspondence analysis for both two algae. [ABSTRACT FROM AUTHOR]

Natural organic matter (NOM), commonly found in surface and ground waters, form disinfection by-products in drinking water. Generally, advanced oxidation processes (AOPs) featuring hydrogen peroxide are used to treat water; however, sulfate radical recently has been used to treat recalcitrant organics, because it is associated with a higher oxidation potential and more effective removal than hydroxyl radicals. Hence, in this research, we evaluated persulfate oxidation efficiency in terms of reductions in humic substance levels and investigated the degradation mechanism. The results showed that ultraviolet-activated persulfate effectively treated humic substances compared with hydrogen peroxide and direct irradiation. Treatment was dose and wavelength dependent; higher persulfate concentrations or shorter UV wavelengths were more effective for treating humic substances as high concentration sulfate radicals were created. The degradation mechanism was similar to that of hydrogen peroxide. Aromatic and chromophore components were more susceptible to degradation than were lower molecular weight components, being initially decomposed into the latter, reducing UV254 absorbance and the SUVA254. Lower molecular weight materials were eventually degraded to end products: NPOC levels fell. And we also treated the inflow of a drinking water treatment plant with persulfate, and humic substances were effectively removed. [ABSTRACT FROM AUTHOR]

Fluorescence spectroscopy can provide high-level chemical characterization and quantification that is suitable for use in online process monitoring and control. However, the high-dimensionality of excitation–emission matrices and superposition of underlying signals is a major challenge to implementation. Herein the use of Convolutional Neural Networks (CNNs) is investigated to interpret fluorescence spectra and predict the formation of disinfection by-products during drinking water treatment. Using deep CNNs, mean absolute prediction error on a test set of data for total trihalomethanes, total haloacetic acids, and the major individual species were all < 6 µg/L and represent a significant difference improved by 39–62% compared to multi-layer perceptron type networks. Heat maps that identify spectral areas of importance for prediction showed unique humic-like and protein-like regions for individual disinfection by-product species that can be used to validate models and provide insight into precursor characteristics. The use of fluorescence spectroscopy coupled with deep CNNs shows promise to be used for rapid estimation of DBP formation potentials without the need for extensive data pre-processing or dimensionality reduction. Knowledge of DBP formation potentials in near real-time can enable tighter treatment controls and management efforts to minimize the exposure of the public to DBPs. [ABSTRACT FROM AUTHOR]

As an emerging class of nitrogenous disinfection by-products, halonitromethanes have caused public health concerns owing to their high toxicity. More and more attention has been paid to the new materials and technologies for the removal of halonitromethanes. In this study, a novel material, nanoscale zero-valent iron (nZVI) supported on MIL-96 (nZVI@MIL-96) with favorable stability and reusability, was synthesized and applied to the adsorption-degradation of trichloronitromethane (TCNM) in the water. The results revealed that almost all the TCNM could be removed under 20 mg/L nZVI@MIL-96 dosage with a wide temperature range. The optimum mass ratio of nZVI to MIL-96 was 1:2, and the TCNM adsorption-degradation followed a pseudo-first-order model. The coexisting ions, such as SO42–, PO43–, and NO3–, with high concentration brought adverse effects on the removal of TCNM; however, the effects of Cl– and CO32– were insignificant. The concentrations of aluminum and iron ions in water were all within the standard value after adsorption with the nZVI@MIL-96. The degradation mechanism of TCNM by nZVI@MIL-96 included two steps, namely, adsorption and degradation, and methylamine was the terminal dechlorination and denitration products. In a word, the as-prepared nZVI@MIL-96 nanoparticles demonstrated the capabilities as a material of adsorption-degradation of TCNM in the water. [ABSTRACT FROM AUTHOR]

There are significant opportunities to optimize drinking water treatment and water resource management using data-driven models. Modelling can help define complex system behaviour, such as water quality and environmental systems, giving insight into expected outcomes from changing conditions. Many water treatment models have been developed, such as predicting treated water quality based on coagulant addition or disinfection by-product formation from chlorination, which can be used to better inform operators of optimal treatment parameters to limit risk and reduce cost. Data-driven models, in particular, present an opportunity to learn relationships from patterns in historical data without the need to pre-define mechanisms or variable interactions. Furthermore, models built on currently monitored data are likely easier to implement since they utilize water quality measures that are already in place. However, data-driven approaches have significant challenges, including increased uncertainty in model validity, challenges in interpreting model behaviour and decision logic, and increased likelihood of incorporating biases from training data. This article presents a review of data-driven model applications in drinking water treatment to highlight opportunities related to protecting source water quality, optimizing treatment processes, and interpreting of sensor data. There is a focus on identifying approaches and algorithms best suited for specific applications and the interpretability of trained models. Successful implementation of data-driven models in critical systems, such as water treatment, requires that models be validated, and a model's decision-making logic can be identified and scrutinized. [ABSTRACT FROM AUTHOR]

The paper discusses the current trends in water disinfection technologies in the operation of swimming pools. Organic substances added to water by personnel or users, when interacting with a disinfectant, are transformed into disinfection by-products (DBPs), the toxicity of which is often unknown. Oxidative technologies are helpful to disinfect water, decrease the concentration of DBPs, and remove already formed compounds. Among the existing methods of water disinfection in swimming pools, the most effective methods are ultraviolet (UV) irradiation in combination with the technology of oxidation of organic compounds. This approach not only comprehensively disinfects the water in the pool but also limits the appearance of disinfection. In this work, we used ultraviolet disinfection of water together with ozonation. The UV dose was measured using a Tensor-31 radiometer. Colony-forming bacteria were controlled according to the requirements of SanPIN 2.1.2.1183-03. The experimental results showed that disinfection of water in the pool using prefiltration and UV irradiation does ensure inactivation of microorganisms, since the total microbial count and total coliforms CFU/cm3 exceed the permissible limits after 48 h. We developed an effective technology for disinfecting water in swimming pools, including an installation of combined action of UV irradiation and ozonation implemented by low-pressure lamps. The installation ensures the necessary irradiance of water at a level of >250 W/m2 and additional ozonation with a dose of ~0.1 g of introduced ozone per 1 m3 of water. Additional ozonation keeps the total microbial number below 24 CFU/cm3, and the residual ozone concentration in water did not exceed 0.015 mg/dm3. For a 75-m3 pool, two installations with a capacity of 8 m3/h ensure the bacteriological purity of water, yielding an irradiance of >250 W/m2 and injecting 0.1 g/m3 of ozone. The concentration of ozone in water does not exceed 0.015 mg/dm3. [ABSTRACT FROM AUTHOR]