Partition coefficients for the carboxylic acids (A) acetic and formic acids between oil and water were measured, correlated, and predicted. The experiments were conducted by equilibrating the systems, soybean oil (SO)-H 2 O-A and fatty acid methyl ester (FAME)-H 2 O-A, at 40°C employing different compositions. The partition coefficients were correlated using the UNIQUAC model and, also, predicted by calculating the activity coefficients of the carboxylic acid in the two phases using a group contribution method, the UNIFAC equation. Agreement of experimental partition coefficients values with those estimated by UNIFAC are fair. Other experimental data from literature were also correlated and are discussed.
The correlation of the data for phase and chemical equilibrium in acetic acid-n-butanol-water-n-butylacetate is presented. The azeotropic properties, the topological structure and the existence of a reactive azeotrope are discussed. The data are correlated by Hayden-O'Connell second virial coefficients and NRTL. Chemical equilibrium constant has a strong influence on the reactive azeotrope.
-A correlation procedure for the prediction of vapor -liquid equilibrium of acetic acid -isopropanol -water -isopropyl acetate mixtures has been developed. It is based on the NRTL model for predicting liquid activity coefficients, and on the Hayden-O'Connell second virial coefficients for predicting the vapor phase of systems containing association components. When compared with experimental data the correlation shows a good agreement for binary and ternary data. The correlation also shows good prediction for reactive quaternary data.
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