Search

Graphical abstract Highlights • The quinacridone-based compounds have excellent NLO properties. • DFT and TDDFT computations were executed to explore the molecules. • All compounds showed maximum absorbance wavelength in the visible region. Abstract In this study, first attempt has been made for theoretical designing of quinacridone (QA) dye and new QA -based compounds (QA-1 to QA-9) were proposed by installing auxiliary donors (dimethylvinyl, methoxy, and N , N -dimethylamine), donor (diphenylamine) and acceptors (cyanoacrylic acid, CN and NO 2) segments into fixed π-bridge QA. DFT and TDDFT calculations with B3LYP/6-31G(d,p) and CAM-B3LYP/6-31G(d,p) functional were used to shed light on the promising structure, charge transport and NLO properties. Introduction of auxiliary donors/donor and acceptor successfully modified the structure which led to superior NLO properties. An eye-catching NLO response was observed in all designed compounds. Interestingly, QA-9 exhibits appealingly large enhancement in NLO properties through ICT process with <α> and β tot computed to be 716.02 (a.u) and 128082.15 (a.u) respectively. UV–Vis results indicates the QA-9 most red shifted among all studied compounds with λ max = 489.02 nm. QA-1 to QA-9 showed narrow HOMO-LUMO energy gap as compared to QA which results in enhanced NLO response. NBO analysis confirms the formation of charge separation state in QA-1 to QA-9 due to successful migration of electrons from auxiliary donors/donor to acceptors via π-bridge. The present research evokes the scientific interest regarding the development of QA based tempting NLO compounds that can be beneficial in modern hi-tech applications. [ABSTRACT FROM AUTHOR]

In this research work, the crosslinked structure of polyurethane has been exploited for sustained drug delivery. Polyurethane composites have been prepared by the reaction of isophorone diisocyanate (IPDI) and polycaprolactone diol (PCL), which were further extended by varying the mole ratios of amylopectin (AMP) and 1,4-butane diol (1,4-BDO) chain extenders. The progress and completion of the reaction of polyurethane (PU) were confirmed using Fourier Transform infrared (FTIR) and nuclear magnetic resonance (1H NMR) spectroscopic techniques. Gel permeation chromatography (GPC) analysis showed that the molecular weights of prepared polymers were increased with the addition of amylopectin into the PU matrix. The molecular weight of AS-4 (M w ≈ 99,367) was found threefold as compared to amylopectin-free PU (M w ≈ 37,968). Thermal degradation analysis was done using thermal gravimetric analysis (TGA) and inferred that AS-5 showed stability up to 600 °C which was the maximum among all PUs because AMP has a large number of –OH units for linking with prepolymer resulting in a more cross-linked structure which improved the thermal stability of the AS-5 sample. The samples prepared with AMP showed less drug release (<53 %) as compared to the PU sample prepared without AMP (AS-1). • Polyurethane (PU) films have been prepared by using blends of amylopectin and 1,4-butane diol. • Reaction of amylopectin (AMP) in the PU was monitored by FTIR and 1H NMR spectroscopy. • Gel permeation chromatography characterization confirmed the chain-extending role of AMP. • Thermal degradation behavior of PU films was influenced by using AMP. • PU films were studied for a controlled release of ciprofloxacin drug. [ABSTRACT FROM AUTHOR]

Highlights: [•] Solution properties can be used to predict the qualitative effects of sweeteners. [•] Scaled particle theory has been used to describe the molecular interactions. [•] Density and sound velocity was measured by using DSA 5000M. [•] The density data was evaluated by using Masson’s equation. [•] The properties give an indication of hydration of the molecule in water. [ABSTRACT FROM AUTHOR]

Abstract: Polyurethane acrylate copolymers (PAC) were synthesized via emulsion polymerization following three step synthesis process using toluene-2,4-diisocyanate, hydroxy terminated poly(caprolactone) diol, 2-hydroxyethylacrylate (HEA) and butyl acrylate (BuA). Structural characteristics of the synthesized polyurethane acrylate copolymer (PAC) were studied using Fourier Transform Infrared (FT-IR) spectrophotometer and are with accordance with the proposed PAC structure. The physicochemical properties such as solid contents (%), tackiness, film appearance and emulsion stability were studied, discussed and co-related with other findings. The plain weave poly-cotton printed fabrics after application of PAC was evaluated applying colorfastness standard test method. The results revealed that emulsion stability is the main controlling factor of the synthesized material in order to get better applications and properties. The emulsion stability of the synthesized material increased with increase in molecular weight of the polycaprolactone diol. [Copyright &y& Elsevier]

Abstract: Hetero-polysaccharide mucilage was extracted from the seed coats of different citrus rootstocks viz. Rough lemon, Sachtion citrumelo and Yuma citrange for investigating its biochemical and molecular properties. Investigations showed that the mucilage contained (mg/g) starch 3.13–5.04; maltose 3.23–4.31; glucosamine 0.017–0.289; d-xylose 0.059–0.107 and total soluble sugars 8.13–11.82. Specific enzyme activities were 16.98–35.96, 30.60–98.45, 42.00–73.98, 660.98–738.35 and 7.660–19.27IUmg−1 of protein for protease, amylase, catalase, peroxidase and superoxide dismutase, respectively. Proximate analysis showed 12.85–13.94% moisture, 11.25–14.06% crude protein, 0.31–0.86% crude lipid, 1.31–2.69% crude fibre, 2.95–3.45% ash and 81.48–91.49kJ 100g−1 energy. The comparative characterization of the extractable proteins was profiled by SDS-PAGE and quantified using Bradford assay. Structural properties of samples were analyzed and compared using Fourier transformation infrared (FT-IR) spectroscopy. [ABSTRACT FROM AUTHOR]

• PANI-GO modified PVDF membranes for efficient water pollution control were successfully developed. • PVDF-PANI-GO nano-filtration membrane was prepared by phase inversion technique. • PANI and GO improved the water flux and mechanical properties of PVDF membrane. • Filtration and antifouling properties were improved by using PANI and GO. Water pollution from the fashion industries containing dyes has become a major source of water pollution. These anthropogenic contaminated waters directly enter irrigation and drinking water systems, causing irreversible environmental damage to human health. Nanomembrane technology has attracted extensive attention to remove these toxic chemicals but new approaches are still required for improving removal efficiency and control the channel size. The work deals with the fabrication of a novel hybrid polyvinylidene fluoride (PVDF)-polyaniline (PANI) membrane with graphene oxide (GO). Incorporation of PANI-GO as a nanofiller has significantly improved antifouling properties and a solvent content of the fabricated membrane. Besides, pure water flux also increases from 112 to 454 L m−2 h−1 indicating the hydrophilic nature of the nanocomposite membrane. Among various compositions, the nanocomposites membrane with 0.1 %w/v GO demonstrated a maximum of 98 % dye rejection at 0.1 MPa operating pressure. After multiple testing of the membrane, the flux recovery ratio reached about 94 % and dyes rejection improved with the addition of PANI-GO. The removal efficiency of the composite membrane for Allura red is 98 % and for methyl orange is 95 %. Based on the above results the PVDF/PANI/GO membranes are recommended for practical use in wastewater treatment, particularly for anionic dyes removal from textile effluents. [ABSTRACT FROM AUTHOR]

The intense urge to replace conventional polymers with ecofriendly monomers is a step towards green products. The novelty of this study is the extraction of starch from the biowaste of wheat bran (WB) and banana peel (BP) for use as a monomer in the form of chain extenders. For the synthesis of polyurethane (PU) elastomers, polyethylene glycol (PEG) bearing an average molecular weight M n = 1000 g mol -1 was used as a macrodiol, which was reacted with isophorone diisocyanate (IPDI) to develop NCO-terminated prepolymer chains. These prepolymer chains were terminated with chain extenders. Two series of linear PU elastomers were prepared by varying the concentration of chain extenders (0.5-2.5 mol%), inducing a variation of 40 to 70 wt% in the hard segment (HS). Fourier-transform infrared (FTIR) spectroscopy confirmed the formation of urethane linkages. Thermal gravimetric analysis (TGA) showed a thermal stability of up to 250 °C. Dynamic mechanical analysis (DMA) revealed a storage modulus ( E ') of up to 140 MPa. Furthermore, the hemolytic activities of up to 8.97 ± 0.1% were recorded. The inhibition of biofilm formation was investigated against E. coli and S. aureus (%), which was supported by phase contrast microscopy., Competing Interests: The authors declare no conflict of interest., (This journal is © The Royal Society of Chemistry.)

The progressive trend of utilizing bioactive materials constitutes diverse materials exhibiting biocompatibility. The innovative aspect of this research is the tuning of the thermo-mechanical behavior of polyurethane (PU) composites with improved biocompatibility for vibrant applications. Polycaprolactone (CAPA) Mn = 2000 g-mol -1 was used as a macrodiol, along with toluene diisocyanate (TDI) and hexamethylene diisocyanate (HMDI), to develop prepolymer chains, which were terminated with 1,4 butane diol (BD). The matrix was reinforced with various concentrations of chitosan (1-5 wt %). Two series of PU composites (PUT/PUH) based on aromatic and aliphatic diisocyanate were prepared by varying the hard segment (HS) ratio from 5 to 30 (wt %). The Fourier-transformed infrared (FTIR) spectroscopy showed the absence of an NCO peak at 1730 cm -1 in order to confirm polymer chain termination. Thermal gravimetric analysis (TGA) showed optimum weight loss up to 500 °C. Dynamic mechanical analysis (DMA) showed the complex modulus (E*) ≥ 200 MPa. The scanning electron microscope (SEM) proved the ordered structure and uniform distribution of chain extender in PU. The hemolytic activities were recorded up to 15.8 ± 1.5% for the PUH series. The optimum values for the inhibition of biofilm formation were recorded as 46.3 ± 1.8% against E. coli and S. aureus (%), which was supported by phase contrast microscopy., Competing Interests: The authors declare no conflicts of interest.

Petrochemical costs, limited fossil fuel reserves, and concerns about greenhouse gas emissions have raised interest in developing renewable approaches for synthesizing biobased polyurethanes. This study aims to solve these problems by making nanocrystalline hydroxyapatite (HA) reinforcement from waste chicken eggshells and adding it to polyurethane synthesis through in situ polymerization. The novelty of the research lies in the utilization of HA as a reinforcement material and renewable resources for polyurethane production. The results confirm that HA was successfully added to the polyurethane backbone. Fourier transform infrared (FTIR) analysis confirmed that the NCO groups were changed to urethane linkages. TGA examination demonstrated that the samples exhibited thermal stability up to 457 °C with a mass loss of 61%, indicating enhanced thermal stability. DMA measurements showed improved mechanical properties of the synthesized polyurethanes, with storage modulus ( E '), complex modulus ( E *), and compliance complex ( D *) values of 0.177, 22.522, and 0.660 MPa -1 , respectively. SEM analysis confirmed the homogeneous surface and well-dispersed HA reinforcement. Swelling characteristics revealed an optimum absorption of 30% H 2 O, 35% CH 3 OH, and 45% CCl 4 . Polyurethane composites exhibited significant chemical resistance and hydrolytic stability in acidic and basic media. Additionally, the composites demonstrated efficient adsorption of methyl orange from wastewater, with the PUHCI series achieving a maximum adsorption capacity of 85.50 mg/g under optimal conditions of 0.030 g/mL dose, 45 °C temperature, 2.5 h contact time, and pH 6.0.., Competing Interests: The authors declare no competing financial interest., (© 2023 The Authors. Published by American Chemical Society.)

Many investigators have focused on the development of biocompatible polyurethanes by chemical reaction of functional groups contained in a spacer and introduced in the PU backbone or by a grafting method on graft polymerization of functional groups. In this study, alginate-based polyurethane (PU) composites were synthesized via step-growth polymerization by the reaction of hydroxyl-terminated polybutadiene (HTPB) and hexamethylene diisocyanate (HMDI). The polymer chains were further extended with blends of 1,4-butanediol (1,4-BDO) and alginate (ALG) with different mole ratios. The structures of the prepared PU samples were elucidated with FTIR and 1 H NMR spectroscopy. The crystallinity of the prepared samples was evaluated with the help of X-ray diffraction (XRD). The XRD results reveal that the crystallinity of the PU samples increases when the concentration of alginate increases. Thermogravimetric (TGA) results show that samples containing a higher amount of alginate possess higher thermal stability. ALG-based PU composite samples show more biocompatibility and less hemolytic activity. Mechanical properties, contact angle, and water absorption (%) were also greatly affected.

The present work aims to examine the structural properties of polyurethanes bio-composites with mole ratios of alginate and chitosan. For this concern, a two-step reaction mechanism was carried out; in the first step isocyanate (-NCO) terminated pre-polymer was synthesized by the reaction of hexamethylene diisocyanate (HMDI) and hydroxyl-terminated polybutadiene (HTPB). The pre-polymer was further extended with 1,4-butanediol (BDO), chitosan (CS) and alginate (ALG) in the second step. Structural and functional group elucidation was done by using Fourier Transform Infra-red (FT-IR) and proton nuclear magnetic resonance ( 1 H NMR) spectroscopy. The crystallinity of the prepared samples was investigated by using X-ray diffraction (XRD) method, the maximum observed intensity was 7704 a.u. The thermal properties of polyurethane composites were carried out using thermogravimetric analysis (TGA) and differential scanning calorimeter (DSC). The TGA results showed that thermal stability of RPU-5 was 20 °C more than RPU-1 at each corresponding degradation temperature. It is observed all physical parameters like crystallinity, glass transition temperature, melting point are much dependent on ratio of chain extenders. Overall, CS based samples along with small amount of ALG showed better thermal properties., (Copyright © 2021 Elsevier B.V. All rights reserved.)

Bionanocomposites is an emerging class of biohybrid materials, have a significant impact in environmental and biomedical fields owing to their high performance, lightweight, unique, and ecofriendly properties. A major challenge in the multiphase bionanocomposites system is to subtle control over the performance by managing the individual properties of reacting components. Herein, we presented the preliminary investigation on bionanocomposite system based on graphene nanoplatelets (GNPs) and hydroxyethyl cellulose graft poly(lactic acid) copolymer-polyurethane (HLAC-PU) with the aim to understand the structure property correlation for proposed applications in electronics and medical areas. The HLAC was fabricated by graft copolymerization of hydroxyethyl cellulose (HEC) and lactic acid (LA) with dibutyltin dilaurate. The HLAC was used to get a bio-functionalized PU matrix reinforced with GNPs by step-growth polymerization method. The structural, surface, and thermal properties of the HLAC and GNPs-HLAC-PU bionanocomposites were studied. The spectroscopic techniques confirmed the structure of bionanocomposites by the identification of related bands. The SEM/EDX results demonstrated that the 0.3 wt% of GNPs dispersed well in the HLAC-PU matrix and offered higher crystallinity. The reinforcement of the 0.3 wt% of GNPs has meaningfully enhanced the thermal stability producing higher residue contents. The reinforced GNPs filler increased the water resistance of bionanocomposites by reducing their water vapor permeability., (Copyright © 2020 Elsevier B.V. All rights reserved.)

2-Hydroxyethyl cellulose graft polylactic acid copolymer (HLAC) was prepared by graft copolymerization of lactic acid (LA) and 2-hydroxyethyl cellulose (2-HEC), initiated by dibutyltin dilaurate (DBTDL) catalyst in aqueous media. Halloysite nanotubes (HNTs)/polyurethane (PU) bionanocomposites were prepared using the HLAC as chain extender in the step-growth polymerization. HNTs were dispersed in HLAC based PU matrix at different weight ratios of 0.30, 0.50, 1.00, and 3.00. Chemical structure and morphology of the graft copolymer and bionanocomposite elastomers were characterized using solid state 1 H NMR, ATR-FTIR, XRD, and SEM-EDX, while thermal degradation behavior was studied by TGA and DSC techniques. Surface morphology of the HNTs reinforced HLAC/PU bio-nanocomposites demonstrated the homogeneous dispersion of HNTs with little wavy rough surface at low contents which turned to be brittle at higher contents due to agglomerated HNTs. It is observed that the lower contents of HNTs were completely exfoliated in the HLAC/PU matrix. Crystalline pattern of the elastomers improved at lower contents of HNTs that enhanced the thermal stability of the bionanocomposites. The mechanical testing suggested that HNTs/HLAC/PU bionanocomposites have higher values of tensile strength and % elongation with only 0.3-0.5 wt% contents of HNTs that suggested the potential applications of elastomers at economic cost., (Copyright © 2020 Elsevier B.V. All rights reserved.)

The present research project is planned to prepare novel biodegradable and biocompatible hydroxyethylcellulose-g-poly(lactic acid) (HEC-g-PLA) blended polyurethanes. Hydroxyl terminated polybutadiene (HTPB) was reacted with isophorone diisocyanate (IPDI) to produce NCO-terminated polyurethane prepolymer and extended further by varying the mole ratio of chain extenders (HEC-g-PLA and BDO). The synthesized polyurethane samples were characterized by using Fourier Transform Infrared (FTIR), proton solid-state NMR ( 1 H SS NMR) and X-ray diffraction (XRD). Thermal behavior of synthesized samples was checked by using thermogravimetric analysis (TGA) and differential scanning calorimetry (DSC). Biological behavior of the synthesized PU samples was also tested by various biological activities which showed much dependence on the mole ratio of chain extenders. Results indicated that incorporation of grafted HEC in to the polyurethane backbone leads to improvement in antibacterial activity, anti-biofilm inhibition, biocompatibility and non-mutagenicity., (Copyright © 2019 Elsevier B.V. All rights reserved.)

Hydroxyethylcellulose (HEC) is a biocompatible, biodegradable, nontoxic, hydrophilic, non- ionic water soluble derivative of cellulose. It is broadly used in biomedical field, paint industry, as a soil amendment in agriculture, coal dewatering, cosmetics, absorbent pads, wastewater treatment and gel electrolyte membranes. Industrial uses of HEC can be extended by the its grafting with different polymers including poly acrylic acid, polyacrylamide, polylactic acid, polyethyleneglycol, polydimethyleamide, polycaprolactone, polylactic acid and dimethylamino ethylmethacrylate. This permits the formation of new biomaterials with improved properties and versatile applications. In this article, a comprehensive overview of graft copolymers of HEC with other polymers/compounds and their applications in drug delivery, stimuli sensitive hydrogels, super absorbents, personal hygiene products and coal dewatering is presented., (Copyright © 2020 Elsevier B.V. All rights reserved.)

Chan-Lam coupling is one of the most popular and easy methods to perform arylation of amines (N-arylations). This cross-coupling is generally performed by reacting aryl boronate derivatives with a variety of substrates involving nitrogen containing functional groups such as amines, amides, ureas, hydrazine, carbamates. This article summarizes the synthetic applications of this reaction and the efforts of scientists to develop novel and efficient methodologies for this reaction.

Curcumin is a naturally occurring constituent of turmeric that is a good substitute for synthetic medicines for the treatment of different diseases, due to its comparatively safer profile. However, there are certain shortcomings that limit its use as an ideal therapeutic agent. In order to overcome these drawbacks, we prepared novel curcumin-loaded mixed polymeric micelles using different biocompatible polymers by the thin-film hydration method. We investigated the critical micelle concentration and temperature, drug loading and encapsulation efficiency, and minimum inhibitory concentration by spectrophotometry. Surface morphology, stability, particle size, drug-polymer interaction, and physical state of the prepared formulations were investigated using scanning electron microscopy, zeta potential, particle size analyzer, Fourier-transform infrared spectroscopy, and X-ray diffraction, respectively. The drug loading and entrapment efficiency were significantly increased (P < 0.01) when curcumin was encapsulated with pluronic-based mixed polymeric micelles as compared to that of pluronic-based micelles alone. In vitro studies exhibited that pluronic-based mixed polymeric micelles significantly increased anticancer (P < 0.01), antimicrobial (P < 0.001), antioxidant (P < 0.001), and α-amylase inhibitory (P < 0.001) activities when compared to pure curcumin and/or pluronic-based micelles alone. These findings suggest that the formation of mixed polymeric micelles increases the stability and solubility of curcumin.

The revival of cultural heritage in a form of natural colorants for textile dyeing is gaining popularity due to their soothing nature and bright shades. The present study was conducted to explore the coloring potential of harmala (Peganum harmala) seeds and to improve color strength of dye using microwave radiations followed by a mordanting process. The results showed that harmala plant seeds could be an excellent source of natural dyes for cotton dyeing if the irradiated acidified methanolic extract (RE, 4 min) is used to dye un-irradiated fabric (NRC) at 85 °C for 45 min using a dye bath of pH 9.0 having salt concentration of 7 g/100 mL. Alum (1%) as pre-mordants and iron (7%) as post-mordants have improved the color strength in chemical mordanting more than other mordants employed. The bio-mordants employed reveal that 10% of acacia as pre-bio-mordants and 7% of acacia as post-bio-mordants are effective amounts to obtain high color strength. Suggested ISO standards for colorfastness illustrate that bio-mordanting has given more excellent rating as compared to chemical mordants. It is concluded that harmala seeds have a great potential to act as a source of natural colorant for cotton dyeing under the influence of microwave radiation.

Activated carbon derived from cones of Pinus roxburghii (Himalayan Pine) was used as an adsorbent for the removal of copper, nickel and chromium ions from waste water. Surface analysis was carried out to determine the specific surface area and pore size distribution of the pine cone derived activated carbon. Optimal parameters, effect of adsorbent quantity, pH, equilibrium time, agitation speed and temperature were studied. Equilibrium data were evaluated by Langmuir and Freundlich isotherm models. Langmuir isotherm afforded the best fit to the equilibrium data with a maximum adsorption capacity of 14.2, 31.4 and 29.6 mg/g for Cu(II), Ni(II) and Cr(VI) respectively. Maximum adsorption of Cu(II), Ni(II) was observed in the pH range 4.0 to 4.5, whereas the best adsorption of Cr(VI) was observed at pH 2.5. It was found that 180 minutes was sufficient to gain adsorption equilibrium. The adsorption process follows a pseudo-second-order kinetic model.

Present research was proposed to evaluate the effect of UV radiation on the dyeing of cellulosic fabrics with direct dyes. The cellulosic fabric was irradiated by using UV radiation assembly (180 W) for different time intervals i.e., 30, 45, 60, 75 and 90 min respectively. The alike set of fabrics was prepared varying the concentration of NaOH during mercerization of the fabrics. All the treated fabrics were dyed with direct dyes. The dyeing parameters such as temperature, time, pH and salt concentration were optimized. The standard methods were employed to evaluate the color strength at various levels of pH, temperature, dyeing contact time and salt concentration. Scanning electron microscope test was performed in order to evaluate the change in fibril structure and surface. The obtained results of the dyed fabrics previously treated with UV radiation and after mercerization were compared. The results revealed that the color strength of UV-irradiated fabric was high as compared to mercerized cellulosic fabrics., (Copyright © 2012 Elsevier Ltd. All rights reserved.)

Polyurethane (PU) prepolymers were prepared by using two different diisocyanates i.e., toluene-2,4-diisocyanate (TDI) and or isophorone diisocyanate (IPDI), and poly (2-methyl-1,3-propylene glutarate), hydroxyl terminated group. PU prepolymer was reacted with 2-hydroxyethylacrylate (HEA) to form vinyl terminated PU prepolymer. Vinyl terminated PU prepolymers were further copolymerized with butyl acrylates (BuA) by emulsion process. The structure of proposed PUACs samples was confirmed by FT-IR, and their physicochemical properties were studied determining solid contents (%), emulsion stability and its appearance, tackiness and film appearance. Their acids and base chemical resistance was also studied and discussed. The synthesized PUACs samples were applied using dip-padding techniques on mill un-desized poly-cotton plain weave fabrics. The results emphasis that PUACs based on toluene-2,4-diisocyanate (TDI) have shown excellent performance against physical and chemical resistance as compared to isophorone diisocyanate (IPDI) based PUACs, however vice versa results were found in some studies., (Copyright © 2011 Elsevier Ltd. All rights reserved.)