Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Vapour-liquid and chemical equilibria in the ethyl ethanoate + ethanol + propyl ethanoate + propanol system accompanied with transesterification reaction

Pavlicek, J.[Jan], Bogdanic, G.[Grozdana], Wichterle, I.[Ivan]
Fluid Phase Equilib. 2012, 328, 61-68
ABSTRACT
Phase and chemical equilibria in the quaternary ethyl ethanoate + ethanol + propyl ethanoate + propanol system and in all six binary subsystems have been investigated at two isotherms, namely at 323.15 and 348.15 K. In total, 116 quaternary experimental points were determined. The binary data were correlated by means of the NRTL model using a robust approach and the maximum likelihood procedure. The binary parameters obtained were used for prediction of vapour-liquid equilibria in the quaternary system and results show a good agreement of calculated and experimental data. The three-dimensional phase diagrams for the quaternary system have been constructed with use of transformed compositions.
Compounds
# Formula Name
1 C4H8O2 ethyl acetate
2 C2H6O ethanol
3 C5H10O2 propyl ethanoate
4 C3H8O propan-1-ol
Datasets
The table above is generated from the ThermoML associated json file (link above). POMD and RXND refer to PureOrMixture and Reaction Datasets. The compound numbers are included in properties, variables, and phases, if specificied; the numbers refer to the table of compounds on the left.
Type Compound-# Property Variable Constraint Phase Method #Points
  • POMD
  • 2
  • 1
  • Azeotropic pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Gas
  • By X=Y
  • 2
  • POMD
  • 2
  • 1
  • Azeotropic temperature, K ; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Gas
  • By X=Y
  • 2
  • POMD
  • 2
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Closed cell (Static) method
  • 36
  • POMD
  • 2
  • 1
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • Chromatography
  • 36
  • POMD
  • 3
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Ebulliometric method (Recirculating still)
  • 26
  • POMD
  • 3
  • 1
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • Chromatography
  • 26
  • POMD
  • 4
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Ebulliometric method (Recirculating still)
  • 29
  • POMD
  • 4
  • 1
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • Chromatography
  • 29
  • POMD
  • 2
  • 3
  • Azeotropic pressure, kPa ; Liquid
  • Mole fraction - 2; Liquid
  • Liquid
  • Gas
  • By X=Y
  • 2
  • POMD
  • 2
  • 3
  • Azeotropic temperature, K ; Liquid
  • Mole fraction - 2; Liquid
  • Liquid
  • Gas
  • By X=Y
  • 2
  • POMD
  • 2
  • 3
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 2; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Ebulliometric method (Recirculating still)
  • 29
  • POMD
  • 2
  • 3
  • Mole fraction - 2 ; Gas
  • Mole fraction - 2; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • Chromatography
  • 29
  • POMD
  • 2
  • 4
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 2; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Ebulliometric method (Recirculating still)
  • 25
  • POMD
  • 2
  • 4
  • Mole fraction - 2 ; Gas
  • Mole fraction - 2; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • Chromatography
  • 25
  • POMD
  • 4
  • 3
  • Azeotropic pressure, kPa ; Liquid
  • Mole fraction - 3; Liquid
  • Liquid
  • Gas
  • By X=Y
  • 2
  • POMD
  • 4
  • 3
  • Azeotropic temperature, K ; Liquid
  • Mole fraction - 3; Liquid
  • Liquid
  • Gas
  • By X=Y
  • 2
  • POMD
  • 4
  • 3
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 3; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Ebulliometric method (Recirculating still)
  • 31
  • POMD
  • 4
  • 3
  • Mole fraction - 3 ; Gas
  • Mole fraction - 3; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • Chromatography
  • 31