Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

(Liquid + liquid) equilibria measurements for ternary systems (sulfolane + a carboxylic acid + n-heptane) at T = 303.15 K and at 0.1 MPa

Cele, N. P., Bahadur, I., Redhi, G. G., Ebenso, E. E.
J. Chem. Thermodyn. 2016, 96, 169-174
ABSTRACT
In the present work, new (liquid + liquid) equilibrium (LLE) values are reported for ternary systems {sulfolane(1) + acetic acid, or propanoic acid, or butanoic acid, or 2-methylpropanoic acid, or pentanoic acid, or 3-methylbutanoic acid (2) + n-heptane (3)} at T = 303.15 K and at p = 0.1 MPa. The mutual solubility of carboxylic acid in sulfolane is dependent on the length and structure of the alkyl chain of the carboxylic acid; it progressively increases with an increase in the alkyl chain of the carboxylic acid. The single phase homogenous region increases as the alkyl chain of the carboxylic acid increases. The n-heptane is most soluble in the carboxylic acid mixtures with long alkyl chain, that is, (3-methylbutanoic acid + sulfolane) and (pentanoic acid + sulfolane) systems and least soluble in the carboxylic acid with short alkyl chain (acetic acid + sulfolane) system. Carboxylic acid together with many other oxygenates and hydrocarbons are produced by SASOL Company in South Africa using the Fischer Tropsch process. The details about this process are given in introduction section. The NRTL and UNIQUAC models were used to correlate the experimental tie-lines and to calculate the phase compositions of the ternary systems. It was found that the NRTL model fits the experimental values significantly better than the UNIQUAC model.
Compounds
# Formula Name
1 C2H4O2 acetic acid
2 C3H6O2 propanoic acid
3 C4H8O2 butanoic acid
4 C4H8O2 2-methylpropanoic acid
5 C5H10O2 pentanoic acid
6 C5H10O2 3-methylbutanoic acid
7 C7H16 heptane
8 C4H8O2S sulfolane
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
  • 4
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 1
  • POMD
  • 7
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 1
  • POMD
  • 8
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 1
  • POMD
  • 1
  • 8
  • 7
  • Mole fraction - 1 ; Liquid mixture 1
  • Mole fraction - 8; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 20
  • POMD
  • 1
  • 8
  • 7
  • Refractive index (Na D-line) ; Liquid
  • Mole fraction - 8; Liquid
  • Mole fraction - 1; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 10
  • POMD
  • 1
  • 8
  • 7
  • Mole fraction - 8 ; Liquid mixture 1
  • Mole fraction - 8 ; Liquid mixture 2
  • Mole fraction - 1 ; Liquid mixture 2
  • Mole fraction - 1; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Index of refraction calibration data
  • Index of refraction calibration data
  • Index of refraction calibration data
  • 5
  • POMD
  • 2
  • 8
  • 7
  • Mole fraction - 2 ; Liquid mixture 1
  • Mole fraction - 8; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 18
  • POMD
  • 2
  • 8
  • 7
  • Refractive index (Na D-line) ; Liquid
  • Mole fraction - 8; Liquid
  • Mole fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 10
  • POMD
  • 2
  • 8
  • 7
  • Mole fraction - 8 ; Liquid mixture 1
  • Mole fraction - 8 ; Liquid mixture 2
  • Mole fraction - 2 ; Liquid mixture 2
  • Mole fraction - 2; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Index of refraction calibration data
  • Index of refraction calibration data
  • Index of refraction calibration data
  • 5
  • POMD
  • 3
  • 8
  • 7
  • Mole fraction - 3 ; Liquid mixture 1
  • Mole fraction - 8; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 17
  • POMD
  • 3
  • 8
  • 7
  • Refractive index (Na D-line) ; Liquid
  • Mole fraction - 8; Liquid
  • Mole fraction - 3; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 10
  • POMD
  • 3
  • 8
  • 7
  • Mole fraction - 8 ; Liquid mixture 1
  • Mole fraction - 8 ; Liquid mixture 2
  • Mole fraction - 3 ; Liquid mixture 2
  • Mole fraction - 3; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Index of refraction calibration data
  • Index of refraction calibration data
  • Index of refraction calibration data
  • 5
  • POMD
  • 4
  • 8
  • 7
  • Mole fraction - 4 ; Liquid mixture 1
  • Mole fraction - 8; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 16
  • POMD
  • 4
  • 8
  • 7
  • Refractive index (Na D-line) ; Liquid
  • Mole fraction - 8; Liquid
  • Mole fraction - 4; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 10
  • POMD
  • 4
  • 8
  • 7
  • Mole fraction - 8 ; Liquid mixture 1
  • Mole fraction - 8 ; Liquid mixture 2
  • Mole fraction - 4 ; Liquid mixture 2
  • Mole fraction - 4; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Index of refraction calibration data
  • Index of refraction calibration data
  • Index of refraction calibration data
  • 5
  • POMD
  • 5
  • 8
  • 7
  • Mole fraction - 5 ; Liquid mixture 1
  • Mole fraction - 8; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 16
  • POMD
  • 5
  • 8
  • 7
  • Refractive index (Na D-line) ; Liquid
  • Mole fraction - 8; Liquid
  • Mole fraction - 5; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 10
  • POMD
  • 5
  • 8
  • 7
  • Mole fraction - 8 ; Liquid mixture 1
  • Mole fraction - 8 ; Liquid mixture 2
  • Mole fraction - 5 ; Liquid mixture 2
  • Mole fraction - 5; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Index of refraction calibration data
  • Index of refraction calibration data
  • Index of refraction calibration data
  • 5
  • POMD
  • 8
  • 7
  • 6
  • Mole fraction - 6 ; Liquid mixture 1
  • Mole fraction - 8; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 16
  • POMD
  • 8
  • 7
  • 6
  • Refractive index (Na D-line) ; Liquid
  • Mole fraction - 8; Liquid
  • Mole fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 10
  • POMD
  • 8
  • 7
  • 6
  • Mole fraction - 8 ; Liquid mixture 1
  • Mole fraction - 8 ; Liquid mixture 2
  • Mole fraction - 6 ; Liquid mixture 2
  • Mole fraction - 6; Liquid mixture 1
  • Temperature, K; Liquid mixture 2
  • Pressure, kPa; Liquid mixture 2
  • Liquid mixture 1
  • Liquid mixture 2
  • Index of refraction calibration data
  • Index of refraction calibration data
  • Index of refraction calibration data
  • 5
  • POMD
  • 8
  • 7
  • Mole fraction - 8 ; Liquid mixture 1
  • Temperature, K; Liquid mixture 1
  • Pressure, kPa; Liquid mixture 1
  • Liquid mixture 1
  • Liquid mixture 2
  • Titration method
  • 2