Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

High pressure densities for mixed ionic liquids having different functionalities: 1-butyl-3-methylimidazolium chloride and 1-butyl- 3-methylimidazolium bis(trifluoromethylsulfonyl)imide

Hiraga, Y.[Yuya], Koyama, K.[Kento], Sato, Y.[Yoshiyuki], Smith Jr., R. L.[Richard L.]
J. Chem. Thermodyn. 2017, 108, 7-17
ABSTRACT
In this work, high pressure density measurements were made of mixed ionic liquid systems (1-butyl-3- methylimidazolium chloride ([bmim]Cl) and 1-butyl-3-methylimidazolium bis(trifluoromethylsulfonyl) imide ([bmim][Tf2N])) for the purpose of developing efficient reaction and separation systems for processing biomass. The mixed ionic liquids were prepared at mole ratios, [bmim]Cl:[bmim][Tf2N] of 0.75: 0.25, 0.50: 0.50 and 0.25: 0.75. Density data were measured (10.200 MPa, 312.392 K) and correlated (up to 100 MPa) with the e.-modified Sanchez-Lacombe equation of state (e.-mod SL EoS). The density of the binary mixed ionic liquid system was modeled in two ways: (i) as a single pseudo-component or (ii) as two discrete components. By treating the mixed ionic liquids as a single pseudo-component, the e.- mod SL EoS could correlate the high pressure density data to within a maximum average relative deviation (ARD) of 0.06%. On the other hand, by treating the mixed ionic liquids as discrete components, higher ARD values (0.15%) were obtained from the e.-mod SL EoS that can be attributed to the EoS mixing rules. Both approaches for modeling the ionic liquid mixtures had sufficiently low deviations and will be applied to multicomponent CO2-containing systems in future works.
Compounds
# Formula Name
1 C8H15ClN2 1-butyl-3-methylimidazolium chloride
2 C10H15F6N3O4S2 1-butyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide
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
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 6
  • POMD
  • 1
  • Viscosity, Pa*s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Concentric cylinders viscometry
  • 6
  • POMD
  • 1
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Vibrating tube method
  • 41
  • POMD
  • 1
  • 2
  • Viscosity, Pa*s ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Concentric cylinders viscometry
  • 41
  • POMD
  • 1
  • 2
  • Mass density, kg/m3 ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Bellows volumetry
  • 300