Thermodynamics Research Center / ThermoML | Journal of Chemical Thermodynamics

High-pressure phase equilibrium data for systems containing carbon dioxide, omega-pentadecalactone, chloroform and water

Rebelatto, Evertan A., Polloni, Andre E., Andrade, Katia S., Bender, Joao P., Corazza, Marcos L., Lanza, Marcelo, Oliveira, J. Vladimir
J. Chem. Thermodyn. 2018, 122, 125-132
ABSTRACT
Experimental phase equilibrium data for the pseudobinary system involving (carbon dioxide + omega-pentadecalactone) and for the pseudoternary system involving (carbon dioxide + omega-pentadecalactone + chloroform) have been measured in order to provide fundamental information to conduct the polymerization reaction in supercritical carbon dioxide medium. The experiments were performed using a variable-volume view cell over the temperature range from 313 K to 343 K, system pressure between 5.4 MPa and 26.1 MPa and different mass ratios of chloroform to (omega-pentadecalactone) (0.5:1, 1:1 and 2:1). Phase transitions of vapour-liquid, liquid-liquid and vapour-liquid-liquid types were observed. The experimental results were modelled using the Peng-Robinson (PR) equation of state with the Wong-Sandler (PR-WS) mixing rule, providing a good representation of the experimental phase equilibrium data.
Compounds
# Formula Name
1 C15H28O2 oxacyclohexadecan-2-one
2 CO2 carbon dioxide
3 H2O water
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
  • 3
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 2; Liquid
  • Solvent: Mass fraction - 3; Liquid
  • Liquid
  • Gas
  • Closed cell (Static) method
  • 68
  • POMD
  • 1
  • 2
  • 3
  • Vapor or sublimation pressure, kPa ; Gas
  • Temperature, K; Gas
  • Mass fraction - 2; Gas
  • Solvent: Mass fraction - 3; Gas
  • Gas
  • Liquid
  • Closed cell (Static) method
  • 43