Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Solubility of hydrofluorocarbons in phosphonium-based ionic liquids: Experimental and modelling study

Sousa, J. M. M. V.[Jose M.M.V.], Granjo, J. F. O.[Jose F.O.], Queimada, A. J.[Antonio J.], Ferreira, A. G. M.[Abel G.M.], Oliveira, N. M. C.[Nuno M.C.], Fonseca, I. M. A.[Isabel M.A.]
J. Chem. Thermodyn. 2014, 79, 184-191
ABSTRACT
In this work, experimental values of gas solubility of hydrofluorocarbons (CHF3, CH2F2 and CH3F) in three room-temperature ionic liquids (RTILs) were determined within the temperature range 288 K to 308 K and at atmospheric pressure. The RTILs used were trihexyltetradecylphosphonium chloride ([P6,6,6,14][Cl]), tributyl(methyl)phosphonium methylsulfate ([P4,4,4,1][C1SO4]), and tributyl(ethyl)phosphonium diethylphosphate ([P4,4,4,2][(C2)2PO4]). The data gathered have been modelled using two approaches: the Cubic plus Association equation of state (CPA EoS) and the regular-solution theory (RST). The experimental measurements were then discussed critically and the modelling results compared.
Compounds
# Formula Name
1 C32H68ClP trihexyl(tetradecyl)phosphonium chloride
2 C14H33O4PS tributylmethylphosphonium methyl sulfate
3 C18H42O4P2 tributylethylphosphonium diethylphosphate
4 CH3F fluoromethane
5 CH2F2 difluoromethane
6 CHF3 trifluoromethane
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
  • 4
  • 1
  • Mole fraction - 4 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Volumetric
  • 5
  • POMD
  • 5
  • 1
  • Mole fraction - 5 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Volumetric
  • 5
  • POMD
  • 6
  • 1
  • Mole fraction - 6 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Volumetric
  • 5
  • POMD
  • 4
  • 2
  • Mole fraction - 4 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Volumetric
  • 5
  • POMD
  • 5
  • 2
  • Mole fraction - 5 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Volumetric
  • 5
  • POMD
  • 6
  • 2
  • Mole fraction - 6 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Volumetric
  • 5
  • POMD
  • 4
  • 3
  • Mole fraction - 4 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Volumetric
  • 5
  • POMD
  • 5
  • 3
  • Mole fraction - 5 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Volumetric
  • 5
  • POMD
  • 6
  • 3
  • Mole fraction - 6 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Volumetric
  • 5