Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Phase behavior and densities of propylene + toluene and ethylene + toluene systems to 580 K and 70 MPa

Mallepally, R. R. [Rajendar R.], Bamgbade, B. A. [Babatunde A.], Cain, N. [Nathaniel], McHugh, Mark A.
Fluid Phase Equilib. 2017, 449, 138-147
ABSTRACT
In this study, we report phase behavior data for propylene + toluene and ethylene + toluene mixtures at temperatures to 580 K and pressures to 8.5 MPa. We also report high-pressure, mixture density data for the two mixtures at temperatures to 555 K and pressures to 70 MPa. Both the phase behavior and density data are simultaneously determined using a windowed variable-volume, high-pressure view cell coupled with a linear variable differential transformer. The phase behavior and mixture density data are modeled with the Soave-Redlich-Kwong (SRK), Peng-Robinson (PR), Modified Sanchez-Lacombe (MSL), and Perturbed-Chain Statistical Associating Fluid Theory (PC-SAFT) equations of state (EoS). The PC-SAFT and MSL EoS provide very good fits of the phase behavior for both the propylene + toluene and ethylene + toluene systems with each binary interaction parameter, kij, set to zero. The PC-SAFT equation also provides the best fit of the high-pressure, mixture density data for the ethylene + toluene system. However, the SRK EoS provides the best fit of the high-pressure, mixture density data for the propylene + toluene system. Although both equations slightly over predict the solution density for the two studied systems, the fit of the densities are insensitive to small variations in kij.
Compounds
# Formula Name
1 C3H6 propene
2 C7H8 toluene
3 C2H4 ethene
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
  • 2
  • Vapor or sublimation pressure, kPa ; Gas
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • visual observation of small bubble
  • 15
  • POMD
  • 1
  • 2
  • Mass density, kg/m3 ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Bellows volumetry
  • 245
  • POMD
  • 3
  • 2
  • Vapor or sublimation pressure, kPa ; Gas
  • Mole fraction - 3; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • visual observation of small bubble
  • 20
  • POMD
  • 3
  • 2
  • Mass density, kg/m3 ; Liquid
  • Mole fraction - 3; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Bellows volumetry
  • 198