Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Determination and modeling of liquid-liquid equilibrium for ternary mixtures of methyl isopropyl ketone, cresol isomers and water

Chen, Y.[Yun], Lv, R.[Ran], Wang, F.[Furong], Li, L.[Libo]
Fluid Phase Equilib. 2016, 429, 107-112
ABSTRACT
Ternary liquid-liquid phase equilibria data for three systems, (methyl isopropyl ketone + o-cresol + water), (methyl isopropyl ketone + m-cresol + water) and (methyl isopropyl ketone + p-cresol + water), were determined at 298.2 and 313.2 K and 101.3 kPa. The ternary phase diagrams composed of liquid-liquid equilibrium (LLE) data were presented graphically. The performance of methyl isopropyl ketone (MIPK) in extracting cresols was evaluated by distribution coefficients and separation factors. It could be concluded from the high distribution coefficients of cresols and separation factors that MIPK is an adequate extractant to extract cresols from its dilute aqueous solutions. The experimental data were correlated by the NRTL and UNIQUAC activity coefficient models. And the deviations between the experimental data and the calculated data from the NRTL and UNIQUAC models are very small, thus the two models both could represent the studied systems well.
Compounds
# Formula Name
1 C7H8O 2-methylphenol
2 C7H8O 3-methylphenol
3 C7H8O 4-methylphenol
4 C5H10O 3-methyl-2-butanone
5 H2O water
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
  • 1
  • 4
  • 5
  • Mass fraction - 1 ; Liquid mixture 1
  • Mass fraction - 1 ; Liquid mixture 2
  • Mass fraction - 4 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 2
  • Mass fraction - 4; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • Chromatography
  • Chromatography
  • 18
  • POMD
  • 2
  • 4
  • 5
  • Mass fraction - 2 ; Liquid mixture 2
  • Mass fraction - 2 ; Liquid mixture 1
  • Mass fraction - 4 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Mass fraction - 4; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • Chromatography
  • Chromatography
  • 18
  • POMD
  • 3
  • 4
  • 5
  • Mass fraction - 3 ; Liquid mixture 2
  • Mass fraction - 3 ; Liquid mixture 1
  • Mass fraction - 4 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Mass fraction - 4; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • Chromatography
  • Chromatography
  • 18
  • POMD
  • 4
  • 5
  • Mass fraction - 4 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 2
  • POMD
  • 4
  • 5
  • Mass fraction - 4 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • 2