Publication | Closed Access
Development of Abraham model expressions for predicting the enthalpies of solvation of solutes dissolved in acetic acid
28
Citations
54
References
2015
Year
EngineeringExperimental ThermodynamicsComputational ChemistryChemistrySolution (Chemistry)Thermodynamic ModellingChemical EngineeringMolecular ThermodynamicsAnalytical ChemistryThermodynamicsEquilibrium Thermodynamic PropertyPrincipal Component AnalysisBiophysicsChemical ThermodynamicsPhysical ChemistryStandard DeviationDeep Eutectic SolventAcetic AcidSolvation ChemistryAbraham Model ExpressionsChemical Kinetics
Experimental data have been compiled from the published chemical and engineering literature on the enthalpies of solvation for 92 different inorganic gases and organic vapours in acetic acid. The compiled data are used to derive mathematical correlations based on the Abraham solvation parameter model. The derived expressions describe the experimental solvation enthalpies in acetic acid to within a standard deviation (SD) of 2.2 kJ mol−1. Principal Component Analysis (PCA) on the five equation coefficients from a derived Abraham model correlation shows that acetic acid does not resemble hydroxylic solvents in terms of enthalpic interactions, but is more akin to moderately polar solvents such as ethyl acetate or acetone.
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