Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

The effect of the naphthenic ring on the VLE of (carbon dioxide + alkane) mixtures

Sima, S.[Sergiu], Milanesio, J. M.[Juan Manuel], Ramello, J. I.[Juan Ignacio], Cismondi, M.[Martin], Secuianu, C.[Catinca], Feroiu, V.[Viorel], Geana, D.[Dan]
J. Chem. Thermodyn. 2016, 93, 374-385
ABSTRACT
Isothermal (vapour + liquid) equilibrium (VLE) data for the binary systems (carbon dioxide + cyclopentane) and (carbon dioxide + cyclohexane) were determined using a (static + analytical) method with phases sampling by rapid online sample injectors (ROLSI) coupled to a gas chromatograph (GC) for analysis. The VLE behaviour for these systems was also analysed based on the PR and RKPR equations of state (EoS) and different available data from the literature, both critical and subcritical. It is clearly shown how CO2 is more soluble and miscible with normal alkanes than with the corresponding cycloalkanes. Predictions based on the general correlation of available data in wide ranges of conditions suggest the appearance of double retrograde behaviour at least for (CO2 + cyclohexane) mixtures with very low contents of the hydrocarbon in CO2, being this phenomenon very much related to asymmetry of the system. The existence of this phenomenon has not been experimentally confirmed yet for these systems and should be explored.
Compounds
# Formula Name
1 CO2 carbon dioxide
2 C5H10 cyclopentane
3 C6H12 cyclohexane
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 ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Closed cell (Static) method
  • 37
  • POMD
  • 1
  • 2
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • Chromatography
  • 37
  • POMD
  • 1
  • 2
  • Critical pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Gas
  • Direct measurement
  • 8
  • POMD
  • 1
  • 2
  • Critical temperature, K ; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • Gas
  • Visual observation in an unstirred cell
  • 8
  • POMD
  • 3
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Closed cell (Static) method
  • 19
  • POMD
  • 3
  • 1
  • Mole fraction - 1 ; Gas
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Gas
  • Liquid
  • Chromatography
  • 19