Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

Phase equilibria of toluene/heptane with deep eutectic solvents based on ethyltriphenylphosphonium iodide for the potential use in the separation of aromatics from naphtha

Kareem, M. A.[Mukhtar A.], Mjalli, F. S.[Farouq S.], Hashim, M. A.[Mohd Ali], Hadj-Kali, M. K. O.[Mohamed K.O.], Bagh, F. S. G.[Fatemeh Saadat Ghareh], AlNashef, I. M.[Inas M.]
J. Chem. Thermodyn. 2013, 65, 138-149
ABSTRACT
In this work, the liquid liquid extraction of toluene from hydrocarbons mixtures (toluene/heptane) was investigated using deep eutectic solvents as solvents. Ethyltriphenylphosphonium iodide as a salt with either ethylene glycol or sulfolane as hydrogen-bond donors (HBDs) were utilized for synthesizing six DESs. (Liquid + liquid) equilibria data were determined experimentally for the ternary system (toluene + heptane + DES) at (30, 40, 50, and 60) C and atmospheric pressure. Hand correlation was applied to establish the reliability of the experimental data. In many cases the correlation factor is found close to unity which indicates high reliability of the data. The selectivities and distribution coefficients were used to determine the suitability of these DESs as solvents for this extraction process. Higher selectivities than those published for sulfolane as a commercial solvent were observed. The DES made from ethyltriphenylphosphonium iodide and sulfolane at salt:HBD of 1:4 showed the best separation capability at 30 C. Thus, it was further characterized by measuring its viscosity and refractive index at a range of temperatures to help understand its physical behaviour needed for process design. The non-random twoliquid (NRTL) model was applied successfully to correlate the experimental tie-lines and to calculate the phase compositions of the ternary systems. It has been found that the third non-randomness parameter varies linearly with the HBD number of moles.
Compounds
# Formula Name
1 C20H20IP ethyltriphenylphosphonium iodide
2 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
  • 2
  • 1
  • Refractive index (Na D-line) ; Liquid
  • Temperature, K; Liquid
  • Mole fraction - 2; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Standard Abbe refractometry
  • 5
  • POMD
  • 2
  • 1
  • Viscosity, Pa*s ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Mole fraction - 2; Liquid
  • Liquid
  • Cone and plate viscometry
  • 5