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

Activity Coefficients at Infinite Dilution for Hydrocarbons in Fatty Alcohols Determined by Gas-Liquid Chromatography

Boussaha, M.[Mehdia], Khimeche, K.[Kamel], Dahmani, A.[Abdellah]
J. Chem. Eng. Data 2011, 56, 4, 850-858
ABSTRACT
The selection of the most suitable selective solvent for separation processes such as extraction or extractive distillation plays an important role in the economical design. Since the largest deviation from ideality is observed at infinite dilution, limiting activity coefficients (?8) provide a useful tool for the optimal choice of the selective solvent. Therefore, activity coefficients at infinite dilution have been measured for 22 solutes (paraffins, olefins, chloroparaffins, aromatics, ketones, ethers, alcohols, and acetates) in fatty alcohols: octadecanol and eicosanol as a solvent. The measurements were carried out with the help of gas-liquid chromatography (GLC) at five and four temperatures, respectively. Furthermore, the observed temperature dependence of limiting activity coefficients is confirmed using excess enthalpy data. To determine the different interactions between the solutes and the solvents, the linear solvation energy relationship (LSER) or Abraham method is applied. To verify the application as an entrainer, the selectivity and capacity of the investigated solvents are calculated from experimental activity coefficient data.
Compounds
# Formula Name
1 C5H12 pentane
2 C18H38O 1-octadecanol
3 C6H14 hexane
4 C8H18 octane
5 CH4O methanol
6 C2H6O ethanol
7 C3H8O propan-1-ol
8 C4H10O butan-1-ol
9 CH2Cl2 dichloromethane
10 C3H7Cl 1-chloropropane
11 C4H9Cl 1-chlorobutane
12 CHCl3 trichloromethane
13 CCl4 tetrachloromethane
14 C3H6O acetone
15 C4H8O tetrahydrofuran
16 C4H8O2 ethyl acetate
17 C6H12O2 butyl ethanoate
18 C2H3N acetonitrile
19 C5H10 1-pentene
20 C7H14 1-heptene
21 C6H12 cyclohexane
22 C7H8 toluene
23 C4H10O diethyl ether
24 C20H42O 1-eicosanol
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
  • 2
  • Activity coefficient - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 3
  • 2
  • Activity coefficient - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 3; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 4
  • 2
  • Activity coefficient - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 4; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 5
  • 2
  • Activity coefficient - 5 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 5; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 6
  • 2
  • Activity coefficient - 6 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 6; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 7
  • 2
  • Activity coefficient - 7 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 7; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 8
  • 2
  • Activity coefficient - 8 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 8; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 9
  • 2
  • Activity coefficient - 9 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 9; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 2
  • 10
  • Activity coefficient - 10 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 10; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 11
  • 2
  • Activity coefficient - 11 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 11; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 12
  • 2
  • Activity coefficient - 12 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 12; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 13
  • 2
  • Activity coefficient - 13 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 13; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 14
  • 2
  • Activity coefficient - 14 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 14; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 15
  • 2
  • Activity coefficient - 15 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 15; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 2
  • 16
  • Activity coefficient - 16 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 16; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 2
  • 17
  • Activity coefficient - 17 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 17; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 18
  • 2
  • Activity coefficient - 18 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 18; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 19
  • 2
  • Activity coefficient - 19 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 19; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 2
  • 20
  • Activity coefficient - 20 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 20; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 21
  • 2
  • Activity coefficient - 21 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 21; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 22
  • 2
  • Activity coefficient - 22 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 22; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 23
  • 2
  • Activity coefficient - 23 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 23; Liquid
  • Liquid
  • GC
  • 5
  • POMD
  • 1
  • 24
  • Activity coefficient - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 1; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 3
  • 24
  • Activity coefficient - 3 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 3; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 4
  • 24
  • Activity coefficient - 4 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 4; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 5
  • 24
  • Activity coefficient - 5 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 5; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 6
  • 24
  • Activity coefficient - 6 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 6; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 7
  • 24
  • Activity coefficient - 7 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 7; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 8
  • 24
  • Activity coefficient - 8 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 8; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 9
  • 24
  • Activity coefficient - 9 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 9; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 10
  • 24
  • Activity coefficient - 10 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 10; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 11
  • 24
  • Activity coefficient - 11 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 11; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 12
  • 24
  • Activity coefficient - 12 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 12; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 13
  • 24
  • Activity coefficient - 13 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 13; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 14
  • 24
  • Activity coefficient - 14 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 14; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 15
  • 24
  • Activity coefficient - 15 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 15; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 16
  • 24
  • Activity coefficient - 16 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 16; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 17
  • 24
  • Activity coefficient - 17 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 17; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 18
  • 24
  • Activity coefficient - 18 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 18; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 19
  • 24
  • Activity coefficient - 19 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 19; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 20
  • 24
  • Activity coefficient - 20 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 20; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 21
  • 24
  • Activity coefficient - 21 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 21; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 22
  • 24
  • Activity coefficient - 22 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 22; Liquid
  • Liquid
  • GC
  • 4
  • POMD
  • 23
  • 24
  • Activity coefficient - 23 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 23; Liquid
  • Liquid
  • GC
  • 4