Thermodynamics Research Center / ThermoML | Journal of Chemical and Engineering Data

Fluid-Phase Behavior of {1-Hexyl-3-methylimidazolium Bis(trifluoromethylsulfonyl) Imide, [C6mim][NTf2], + C2-C8 n-Alcohol} Mixtures: Liquid-Liquid Equilibrium and Excess Volumes

Lachwa, J.[Joanna], Morgado, P.[Pedro], Esperanca, J. M. S. S.[Jose M. S. S.], Guedes, H. J. R.[Henrique J. R.], Lopes, J. N. C.[Jose N. Canongia], Rebelo, L. P. N.[Luis Paulo N.]
J. Chem. Eng. Data 2006, 51, 6, 2215-2221
ABSTRACT
In the frame of the IUPAC Project entitled Thermodynamics of ionic liquids, ionic liquid mixtures, and the deVelopment of standarized systems, 1-hexyl-3-methylimidazolium bis(trifluoromethylsulfonyl) imide, [C6mim]- [NTf2], was selected as the model ionic liquid to perform round-robin measurements on a series of ionic liquid properties. In this work, the temperature-composition liquid-liquid equilibria of this ionic liquid with linear alkan-1-ols, CnH(2n+1)OH, with n ) 4, 5, 6, and 8, were determined at a nominal pressure of 0.1 MPa and up to 50 MPa for n ) 4, 5, and 6. Excess molar volumes, VE, of mixtures of this same ionic liquid with linear alkan- 1-ols, CnH2n+1OH, with n ranging from 2 to 5, were measured at a nominal pressure of 0.1 MPa. The consistency between the two sets of experimental data (phase diagrams and VE) was analyzed from a theoretical perspective; we noticed that as the alkyl chain length, n, of the linear alcohol varies both the pressure dependence of the phase diagrams and the critical excess molar volume change sign.
Compounds
# Formula Name
1 C12H19F6N3O4S2 1-hexyl-3-methylimidazolium bis[(trifluoromethyl)sulfonyl]imide
2 C2H6O ethanol
3 C3H8O propan-1-ol
4 C4H10O butan-1-ol
5 C5H12O pentan-1-ol
6 C6H14O hexan-1-ol
7 C8H18O octan-1-ol
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
  • VIBTUB:UFactor:4
  • 21
  • POMD
  • 2
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:4
  • 6
  • POMD
  • 3
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:4
  • 6
  • POMD
  • 4
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:2
  • 6
  • POMD
  • 5
  • Mass density, kg/m3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • VIBTUB:UFactor:8
  • 3
  • POMD
  • 2
  • 1
  • Excess molar volume, m3/mol ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calculated with densities of this investigation
  • 36
  • POMD
  • 3
  • 1
  • Excess molar volume, m3/mol ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calculated with densities of this investigation
  • 21
  • POMD
  • 4
  • 1
  • Liquid-liquid equilibrium temperature, K ; Liquid mixture 1
  • Mass fraction - 1; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • VISOBS
  • 15
  • POMD
  • 4
  • 1
  • Liquid-liquid equilibrium temperature, K ; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Mass fraction - 1; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • VISOBS
  • 5
  • POMD
  • 4
  • 1
  • Excess molar volume, m3/mol ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calculated with densities of this investigation
  • 30
  • POMD
  • 5
  • 1
  • Liquid-liquid equilibrium temperature, K ; Liquid mixture 1
  • Mass fraction - 1; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • VISOBS
  • 20
  • POMD
  • 5
  • 1
  • Liquid-liquid equilibrium temperature, K ; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Mass fraction - 1; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • VISOBS
  • 11
  • POMD
  • 5
  • 1
  • Excess molar volume, m3/mol ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calculated with densities of this investigation
  • 18
  • POMD
  • 6
  • 1
  • Liquid-liquid equilibrium temperature, K ; Liquid mixture 1
  • Mass fraction - 1; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • VISOBS:UFactor:2
  • 20
  • POMD
  • 6
  • 1
  • Liquid-liquid equilibrium temperature, K ; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Mass fraction - 1; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • VISOBS
  • 10
  • POMD
  • 7
  • 1
  • Liquid-liquid equilibrium temperature, K ; Liquid mixture 1
  • Mass fraction - 1; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • VISOBS
  • 17