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

Experimental and Predicted Excess Molar Enthalpies of the Ternary System tert-Butyl Methyl Ether + 1-Pentanol + Decane at 298.15 K

Verdes, P. V.[Pedro V.], Mato, M. M.[Marta M.], Illobre, M.[Monica], Cebreiro, S. M.[Susana M], Legido, J. L.[Jose Luis], Paz Andrade, M. I.[Maria Inmaculada]
J. Chem. Eng. Data 2004, 49, 6, 1703-1709
ABSTRACT
Excess molar enthalpies of {x1 tert-butyl methyl ether (MTBE) + x2 1-pentanol+ (1-x1-x2) decane} and, the involved binary mixtures {x tert-butyl methyl ether (MTBE) + (1-x) decane} and {x 1-pentanol+ (1-x) decane} have been determined at the temperature of 298.15 K and atmospheric pressure, over the whole composition range, using a Calvet microcalorimeter. The results were fitted by means of different variable degree polynomials. In the present work, we propose a new expression to fit the ternary excess molar enthalpy, which do take into account the asymmetric shape of the involved binary systems. The group contribution model of the UNIFAC (in the versions of Larsen, and Gmehling) were used to estimate excess enthalpy values. Several empirical expressions for estimating ternary properties from binary results were also tested.
Compounds
# Formula Name
1 C5H12O 2-methoxy-2-methylpropane
2 C5H12O pentan-1-ol
3 C10H22 decane
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
  • Excess molar enthalpy (molar enthalpy of mixing), kJ/mol ; Liquid
  • Mole fraction - 1; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calvet calorimetry
  • 20
  • POMD
  • 2
  • 3
  • Excess molar enthalpy (molar enthalpy of mixing), kJ/mol ; Liquid
  • Mole fraction - 2; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calvet calorimetry
  • 19
  • POMD
  • 2
  • 3
  • 1
  • Excess molar enthalpy (molar enthalpy of mixing), kJ/mol ; Liquid
  • Solvent: Mole fraction - 1; Liquid
  • Mole fraction - 3; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Calvet calorimetry
  • 53