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

Ionic Liquids/Water Distribution Ratios of Some Polycyclic Aromatic Hydrocarbons

Liu, J.-f.[Jing-fu], Chi, Y.-g.[Yu-guang], Peng, J.-f.[Jin-feng], Jiang, G.-b.[Gui-bin], Jonsson, J. A.[Jan Ake]
J. Chem. Eng. Data 2004, 49, 5, 1422-1424
ABSTRACT
By using the shake-flask procedure, the distribution ratios (D) at infinite dilution and 298.1 K of 15 polycyclic aromatic hydrocarbons (PAHs) between room-temperature ionic liquids, 1-alkyl-3-methylimiazolium hexafluorophosphates ([CnMIM][PF6], n ) 4 and 8), and water were determined. The log D values are in the range of 3.34-4.36, which increased very slowly with the molar mass of PAHs.
Compounds
# Formula Name
1 C10H8 naphthalene
2 C12H10 acenaphthene
3 C13H10 fluorene
4 C14H10 phenanthrene
5 C14H10 anthracene
6 C16H10 fluoranthene
7 C16H10 pyrene
8 C18H12 benz[a]anthracene
9 C18H12 chrysene
10 C20H12 benz[e]acephenanthrylene
11 C20H12 benzo[k]fluoranthene
12 C20H12 benzo[a]pyrene
13 C22H14 dibenz[a,h]anthracene
14 C22H12 benzo[ghi]perylene
15 H2O water
16 C8H15F6N2P 1-butyl-3-methylimidazolium hexafluorophosphate
17 C12H23F6N2P 1-octyl-3-methylimidazolium hexafluorophosphate
18 C22H12 indeno[1,2,3-cd]pyrene
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
  • 15
  • 16
  • Mass concentration, kg/m3 - 1 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 1; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 2
  • 15
  • 16
  • Mass concentration, kg/m3 - 2 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Mole fraction - 2; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 3
  • 15
  • 16
  • Mass concentration, kg/m3 - 3 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 3; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 4
  • 15
  • 16
  • Mass concentration, kg/m3 - 4 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 4; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 5
  • 15
  • 16
  • Mass concentration, kg/m3 - 5 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 5; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 6
  • 15
  • 16
  • Mass concentration, kg/m3 - 6 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 6; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 7
  • 15
  • 16
  • Mass concentration, kg/m3 - 7 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 7; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 8
  • 15
  • 16
  • Mass concentration, kg/m3 - 8 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 8; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 9
  • 15
  • 16
  • Mass concentration, kg/m3 - 9 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 9; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 10
  • 15
  • 16
  • Mass concentration, kg/m3 - 10 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 10; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 11
  • 15
  • 16
  • Mass concentration, kg/m3 - 11 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 11; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 12
  • 15
  • 16
  • Mass concentration, kg/m3 - 12 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 12; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 13
  • 15
  • 16
  • Mass concentration, kg/m3 - 13 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 13; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 14
  • 15
  • 16
  • Mass concentration, kg/m3 - 14 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 14; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 1
  • 15
  • 17
  • Mass concentration, kg/m3 - 1 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 1; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 2
  • 15
  • 17
  • Mass concentration, kg/m3 - 2 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 2; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 3
  • 15
  • 17
  • Mass concentration, kg/m3 - 3 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 3; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 4
  • 15
  • 17
  • Mass concentration, kg/m3 - 4 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 4; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 5
  • 15
  • 17
  • Mass concentration, kg/m3 - 5 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 5; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 6
  • 15
  • 17
  • Mass concentration, kg/m3 - 6 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 6; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 7
  • 15
  • 17
  • Mass concentration, kg/m3 - 7 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 7; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 8
  • 15
  • 17
  • Mass concentration, kg/m3 - 8 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 8; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 9
  • 15
  • 17
  • Mass concentration, kg/m3 - 9 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 9; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 10
  • 15
  • 17
  • Mass concentration, kg/m3 - 10 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 10; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 11
  • 15
  • 17
  • Mass concentration, kg/m3 - 11 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 11; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 12
  • 15
  • 17
  • Mass concentration, kg/m3 - 12 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 12; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 13
  • 15
  • 17
  • Mass concentration, kg/m3 - 13 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 13; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 14
  • 15
  • 17
  • Mass concentration, kg/m3 - 14 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Mole fraction - 14; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 18
  • 15
  • 16
  • Mass concentration, kg/m3 - 18 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Mole fraction - 18; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1
  • POMD
  • 18
  • 15
  • 17
  • Mass concentration, kg/m3 - 18 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Mole fraction - 18; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Chromatography
  • 1