Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Volumetric behaviour of six ionic liquids from T = (278 to 398) K and up to 120 MPa

Gacino, F. M.[Felix M.], Regueira, T.[Teresa], Bolotov, A. V.[Alexander V.], Sharipov, A.[Artur], Lugo, L.[Luis], Comunas, M. J. P.[Maria J.P.], Fernandez, J.[Josefa]
J. Chem. Thermodyn. 2016, 93, 24-33
ABSTRACT
In this paper the volumetric behaviour of the ionic liquids 1-butyl-1-methylpyrrolidinium tetracyanoborate, 1-butyl-1-methylpyrrolidinium trifluoromethanesulfonate, 1-butyl-1-methylpyrrolidinium tris (pentafluoroethyl)trifluorophosphate, 1,3-dimethylimidazolium dimethylphosphate, 1-ethyl-3-methylimidazolium hexylsulfate, and trihexyl(tetradecyl)phosphonium tris(pentafluoroethyl)trifluoropho sphate is reported. Density was measured over the temperature range (278.15 to 398.15) K up to 120 MPa by means of a high pressure densimeter based on the vibrating tube principle. Experimental values were correlated as a function of temperature and pressure by means of the Tammann Tait equation obtaining standard deviations lower than 3.10-4 g.cm-3. From this correlation, isothermal compressibility and isobaric thermal expansivity are obtained by differentiation. Furthermore, two group contribution methods proposed by Gardas and Coutinho and by Jacquemin et al. are applied to these fluids to analyse their prediction abilities to determine densities, as well as an equation proposed by Kiselev et al. to obtain isothermal compressibility at 0.1 MPa.
Compounds
# Formula Name
1 C7H15N2O4P 1,3-dimethylimidazolium dimethylphosphate
2 C12H24N2O4S 3-ethyl-1-methyl-1H-imidazolium hexyl sulfate
3 C13H20BN5 1-butyl-1-methylpyrrolidinium tetracyanoborate
4 C10H20F3NO3S 1-butyl-1-methylpyrrolidinium trifluoromethanesulfonate
5 C15H20F18NP 1-butyl-1-methylpyrrolidinium tris(pentafluoroethyl)trifluorophosphate
6 C38H68F18P2 trihexyl(tetradecyl)phosphonium tris(pentafluoroethyl)trifluorophosphate
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
  • Viscosity, Pa*s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Concentric cylinders viscometry
  • 1
  • POMD
  • 1
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 63
  • POMD
  • 2
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 63
  • POMD
  • 3
  • Viscosity, Pa*s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Concentric cylinders viscometry
  • 1
  • POMD
  • 3
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 75
  • POMD
  • 4
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 63
  • POMD
  • 5
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 63
  • POMD
  • 6
  • Mass density, kg/m3 ; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Vibrating tube method
  • 63