Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Separation of aromatic hydrocarbons (toluene or benzene) from aliphatic hydrocarbon (n-heptane) by extraction with ethylene carbonate

Mohsen-Nia, M., Doulabi, F. S. M.
J. Chem. Thermodyn. 2010, 42, 10, 1281-1285
ABSTRACT
Selectivity factors and partition coefficients of ethylene carbonate and the (ethylene carbonate + sulfolane) solvent mixture for the separation of benzene or toluene from (benzene or toluene + n-heptane) are obtained from the experimental (liquid + liquid) equilibrium data for ternary mixtures of (ethylene carbonate + benzene or toluene + n-heptane) at temperatures of (303.15 and 313.15) K and quaternary mixture of (ethylene carbonate + sulfolane + benzene + n-heptane) at 303.15 K. The composition of liquid phases at equilibrium was determined by gas-liquid chromatography and the results were correlated with the UNIQUAC and NRTL activity coefficient models. The parameters of the models were evaluated and reported. The phase diagrams for the mixtures studied are presented and the correlated tie line results have been compared with the experimental results. The comparisons indicate the applicability of the UNIQUAC and NRTL activity coefficients model for (liquid + liquid) equilibrium calculations of the mixtures studied.
Compounds
# Formula Name
1 C3H4O3 ethylene carbonate
2 C7H8 toluene
3 C6H6 benzene
4 C7H16 heptane
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
  • 3
  • 1
  • 4
  • Mole fraction - 3 ; Liquid mixture 2
  • Mole fraction - 1 ; Liquid mixture 1
  • Mole fraction - 3 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Mole fraction - 1; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 2
  • Liquid mixture 1
  • Chromatography
  • Chromatography
  • Chromatography
  • 10
  • POMD
  • 1
  • 2
  • 4
  • Mole fraction - 2 ; Liquid mixture 1
  • Mole fraction - 2 ; Liquid mixture 2
  • Mole fraction - 1 ; Liquid mixture 2
  • Temperature, K; Liquid mixture 2
  • Mole fraction - 1; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • Chromatography
  • Chromatography
  • 12