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

Solid-Liquid Phase Equilibria of 1-Decanol and 1-Dodecanol with Fragrance Raw Materials Based on Cyclohexane

Domanska, U.[Urszula], Morawski, P.[Piotr], Piekarska, M.[Maria]
J. Chem. Eng. Data 2009, 54, 4, 1271-1276
ABSTRACT
The solid-liquid phase equilibria (SLE) of binary mixtures containing 1-decanol or 1-dodecanol and fragrance raw materials based on cyclohexane were investigated. The systems {1-decanol or 1-dodecanol (1) + cyclohexyl carboxylic acid (CCA) or cyclohexyl acetic acid (CAA) or cyclohexyl acetate (CA) or 2-cyclohexyl ethyl acetate (2CEA) or 2-cyclohexyl ethanol (2CE) (2)} have been measured by a dynamic method over a wide range of temperature from (250 to 300) K and ambient pressure. For all systems, SLE diagrams were detected as eutectic mixtures with complete miscibility in the liquid phase. The experimental data were correlated by the Wilson and the nonrandom two-liquid NRTL equation, utilizing parameters derived from the solid-liquid equilibrium. The average root-mean-square deviations of the solubility temperatures were (0.33 and 0.31) K for the Wilson and the NRTL equations, respectively.
Compounds
# Formula Name
1 C7H12O2 cyclohexanecarboxylic acid
2 C8H14O2 cyclohexylethanoic acid
3 C8H14O2 cyclohexyl ethanoate
4 C10H18O2 cyclohexylethyl acetate
5 C8H16O 2-cyclohexylethanol
6 C10H22O decan-1-ol
7 C12H26O dodecan-1-ol
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
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • VISOBS:UFactor:8
  • 1
  • POMD
  • 2
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • VISOBS::UFactor:8
  • 1
  • POMD
  • 6
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • VISOBS::UFactor:2
  • 1
  • POMD
  • 7
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • VISOBS::UFactor:4
  • 1
  • POMD
  • 1
  • 6
  • Eutectic temperature, K ; Crystal - 1
  • Crystal - 1
  • Crystal - 6
  • Liquid
  • Air at 1 atmosphere
  • PHASDIA:
  • 1
  • POMD
  • 1
  • 6
  • Eutectic composition: mole fraction - 6 ; Crystal - 1
  • Crystal - 1
  • Crystal - 6
  • Liquid
  • Air at 1 atmosphere
  • PHASDIA:
  • 1
  • POMD
  • 1
  • 6
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • VISOBS:UFactor:8
  • 11
  • POMD
  • 1
  • 6
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 6
  • VISOBS:UFactor:2
  • 7
  • POMD
  • 6
  • 2
  • Eutectic temperature, K ; Crystal - 6
  • Crystal - 6
  • Crystal - 2
  • Liquid
  • Air at 1 atmosphere
  • PHASDIA:
  • 1
  • POMD
  • 6
  • 2
  • Eutectic composition: mole fraction - 6 ; Crystal - 6
  • Crystal - 6
  • Crystal - 2
  • Liquid
  • Air at 1 atmosphere
  • Derived from phase diagram analysis
  • 1
  • POMD
  • 6
  • 2
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • VISOBS:UFactor:8
  • 14
  • POMD
  • 6
  • 2
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 6
  • VISOBS:UFactor:2
  • 9
  • POMD
  • 6
  • 3
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 6
  • VISOBS:UFactor:2
  • 30
  • POMD
  • 6
  • 4
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 6
  • VISOBS:UFactor:2
  • 23
  • POMD
  • 6
  • 5
  • Liquid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 6; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Liquid - 6
  • VISOBS:UFactor:4
  • 15
  • POMD
  • 1
  • 7
  • Eutectic temperature, K ; Crystal - 1
  • Crystal - 1
  • Crystal - 7
  • Liquid
  • Air at 1 atmosphere
  • PHASDIA:
  • 1
  • POMD
  • 1
  • 7
  • Eutectic composition: mole fraction - 7 ; Crystal - 1
  • Crystal - 1
  • Crystal - 7
  • Liquid
  • Air at 1 atmosphere
  • Derived from phase diagram analysis
  • 1
  • POMD
  • 1
  • 7
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 7; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • VISOBS:UFactor:6
  • 11
  • POMD
  • 1
  • 7
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 7; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 7
  • VISOBS:UFactor:4
  • 11
  • POMD
  • 7
  • 2
  • Eutectic temperature, K ; Crystal - 7
  • Crystal - 7
  • Crystal - 2
  • Liquid
  • Air at 1 atmosphere
  • PHASDIA:
  • 1
  • POMD
  • 7
  • 2
  • Eutectic composition: mole fraction - 7 ; Crystal - 7
  • Crystal - 7
  • Crystal - 2
  • Liquid
  • Air at 1 atmosphere
  • Derived from phase diagram analysis
  • 1
  • POMD
  • 7
  • 2
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 7; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 2
  • VISOBS:UFactor:4
  • 10
  • POMD
  • 7
  • 2
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 7; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 7
  • VISOBS:UFactor:4
  • 12
  • POMD
  • 7
  • 3
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 7; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 7
  • VISOBS:UFactor:4
  • 36
  • POMD
  • 7
  • 4
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 7; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 7
  • VISOBS:UFactor:4
  • 35
  • POMD
  • 7
  • 5
  • Solid-liquid equilibrium temperature, K ; Liquid
  • Mole fraction - 7; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 7
  • VISOBS:UFactor:4
  • 12