Search

The hydrodynamic cavitation multiphase reactor (HCMR) is emerging as a promising alternative for the intensification of liquid–liquid heterogeneous reactions, but research on HCMR modeling is lacking. In this article, an HCMR model was developed using Prileschajew epoxidation as the model system. First, based on experimental measurements of oil/water two‐phase flow downstream of hydrodynamic cavitation devices, semiempirical correlations were proposed to describe the droplet size and droplet size distribution (DSD) as functions of flow conditions and geometry parameters. Then, with boundary conditions calculated by the DSD correlation, a droplet dynamics simulation in a reaction tank was performed by computational fluid dynamics coupled with population balance model to obtain the two‐phase interfacial area. Finally, the acquired reactor model was substituted into an overall kinetic model, to simulate the epoxidation reaction in HCMR. Model predictions were verified by experimental results measured on an industrial scale HCMR. [ABSTRACT FROM AUTHOR]

Epoxidized oils are eco‐friendly plasticizers, which are industrially produced through the epoxidation reaction in a formic acid‐hydrogen peroxide autocatalyzed system. The fundamental knowledge to describe the phase equilibrium of systems after epoxidation reaction is lacking, which is crucial for the design of the purification facilities. This work reported experimental data for the liquid–liquid equilibrium of three systems, i.e., epoxidized fatty acid methyl esters + formic acid + water, epoxidized fatty acid 2‐ethylhexyl esters + formic acid + water, and epoxidized soybean oil + formic acid + water, in the temperature range (303.15–348.15) K under atmospheric pressure. The results indicated that the liquid–liquid equilibrium constant of formic acid in the systems followed the order of epoxidized fatty acid 2‐ethylhexyl esters > epoxidized fatty acid methyl esters > epoxidized soybean oil. Moreover, the obtained experimental data were correlated using nonrandom two liquid (NRTL) and universal quasi chemical (UNIQUAC) models. The maximum root mean square deviation (RMSD) values as low as 0.0052 and 0.0263 were estimated using the NRTL and UNIQUAC model, respectively. The NRTL model is more suitable than the UNIQUAC model to describe the liquid–liquid equilibrium behavior of these ternary systems. [ABSTRACT FROM AUTHOR]

In this study, the mass transfer and reaction kinetics of soybean oil epoxidation using concentrated hydrogen peroxide in a formic acid-autocatalyzed reaction system were studied in detail. Studying the mass transfer of formic acid showed that the influence of reactant diffusion near the interface is eliminated when the stirring rate is > 120 rpm in a double-stirred cell, and the mass transfer rate decreases greatly with the conversion of double bonds and a decrease of reaction temperature. A temperature increase has little impact on the equilibrium of formic acid in the oil/water system, while an increase of epoxidized soybean oil significantly increases the value of the partition coefficient of formic acid. Another important aspect in the kinetic study is the decomposition of performic acid, which can cause the reduction of H2O2 and formic acid during the reaction. Finally, a biphasic model, which considers all reactions in oil and aqueous phases, the equilibrium and mass transfer of reagents and products between the phases, and the evolution of proton concentrations with time, was developed to describe the epoxidation process. [ABSTRACT FROM AUTHOR]