Thermodynamics Research Center / ThermoML | Fluid Phase Equilibria

Phase equilibria of high molecular mass 1-alcohols in supercritical propane

Schwarz, C. E., Knoetze, J. H.
Fluid Phase Equilib. 2007, 258, 1, 51-57
ABSTRACT
The phase equilibria of high molecular mass 1-alcohols in supercritical propane is measured to investigate the relationship between the phase equilibrium pressure and the number of carbon atoms and by comparison with n-alkanes, to show the effect of the hydroxyl group. Binary phase equilibrium measurements of high molecular mass 1-alcohols (with 10, 12, 16, 18 and 22 carbon atoms) in supercritical propane are measured between 378 and 408K for 1-alcohol mass fractions of 0.0175 0.600. Complete solubility below 100 bar, with no region of liquid liquid immiscibility, is observed and the phase transition pressure increases with increasing number of carbon atoms. By plotting the number of carbon atoms as a function of the phase transition pressure at constant temperature and mass fraction 1-alcohol, a linear relationship is realized. This linear relationship can be used to estimate the phase equilibrium of 1-alcohols with 10 22 carbon atoms in propane. When the measured 1-alcohol propane data is compared to published n-alkane propane data it can be seen that the hydroxyl group has the effect of increasing the phase equilibrium pressure of the 1-alcohol in comparison to the n-alkane.
Compounds
# Formula Name
1 C3H8 propane
2 C10H22O decan-1-ol
3 C12H26O dodecan-1-ol
4 C16H34O 1-hexadecanol
5 C18H38O 1-octadecanol
6 C22H46O 1-docosanol
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
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 2; Liquid
  • Liquid
  • Gas
  • CCELL:UFactor:8
  • 33
  • POMD
  • 1
  • 3
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 3; Liquid
  • Liquid
  • Gas
  • CCELL:UFactor:8
  • 36
  • POMD
  • 1
  • 4
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 4; Liquid
  • Liquid
  • Gas
  • CCELL:UFactor:8
  • 39
  • POMD
  • 1
  • 5
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 5; Liquid
  • Liquid
  • Gas
  • CCELL:UFactor:8
  • 36
  • POMD
  • 1
  • 6
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Mass fraction - 6; Liquid
  • Liquid
  • Gas
  • CCELL:UFactor:8
  • 36