Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Activity coefficients at infinite dilution measurements for organic solutes in the ionic liquid hexyl-3-methyl-imidazolium bis(trifluoromethylsulfonyl)-imide using g.l.c. at T = (298.15, 313.15, and 333.15) K

Letcher, T. M.[Trevor M.], Marcininiak, A.[Andrzej], Marciniak, M.[Malgorzata], Domanska, U.[Urszula]
J. Chem. Thermodyn. 2005, 37, 12, 1327-1331
ABSTRACT
The activity coefficients at infinite dilution, c113 (where 1 refers to the solute and 3 to the solvent), for both polar and non-polar solutes (alkanes, alk-1-enes, alk-1-ynes, cycloalkanes, benzene, carbon tetrachloride, and methanol) in the ionic liquid 1-hexyl-3- methyl-imidazolium bis(trifluoromethylsulfonyl)-imide [HMIM][Tf2N] at three temperatures T = (298.15, 313.15, and 333.15) K have been determined by gas liquid chromatography. The interaction at the gas liquid interface between the solutes and the solvent was examined by varying solvent liquid loading on the column. Corrected retention values, taking carrier gas and solute imperfections into account, were determined and used to calculate the activity coefficients at infinite dilution. The results have been used to predict the solvent potential for the hexane/benzene separation from calculated selectivity values. The results were compared to c113 for similar systems found in the literature in an attempt to understand the effect of the nature of the cation and anion has on solute solvent interactions. The partial molar excess enthalpies at infinite dilution values DHE1 1 were calculated from the experimental c113 values obtained over the temperature range.
Compounds
# Formula Name
1 C12H19F6N3O4S2 1-hexyl-3-methylimidazolium bis[(trifluoromethyl)sulfonyl]imide
2 C5H12 pentane
3 C6H14 hexane
4 C7H16 heptane
5 C8H18 octane
6 C6H12 hex-1-ene
7 C8H16 oct-1-ene
8 C6H10 1-hexyne
9 C7H12 1-heptyne
10 C8H14 1-octyne
11 C5H10 cyclopentane
12 C6H12 cyclohexane
13 C7H14 cycloheptane
14 C6H6 benzene
15 CCl4 tetrachloromethane
16 CH4O methanol
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
  • 3
  • 1
  • Activity coefficient - 3 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 3; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 4
  • 1
  • Activity coefficient - 4 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 4; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 5
  • 1
  • Activity coefficient - 5 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 5; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 6
  • 1
  • Activity coefficient - 6 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 6; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 7
  • 1
  • Activity coefficient - 7 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 7; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 8
  • 1
  • Activity coefficient - 8 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 8; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 9
  • 1
  • Activity coefficient - 9 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 9; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 10
  • 1
  • Activity coefficient - 10 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 10; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 11
  • 1
  • Activity coefficient - 11 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 11; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 12
  • 1
  • Activity coefficient - 12 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 12; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 13
  • 1
  • Activity coefficient - 13 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 13; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 14
  • 1
  • Activity coefficient - 14 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 14; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 15
  • 1
  • Activity coefficient - 15 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 15; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 16
  • 1
  • Activity coefficient - 16 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 16; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3
  • POMD
  • 2
  • 1
  • Activity coefficient - 2 ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 2; Liquid
  • Liquid
  • Gas
  • CHROM:UFactor:2
  • 3