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

Vaporization, Sublimation and Fusion Enthalpies of Some Saturated and Unsaturated Long Chain Fatty Acids by Correlation Gas Chromatography

Wilson, J.[Joe], Gobble, C.[Chase], Chickos, J. S.[James S.]
J. Chem. Eng. Data 2015, 60, 1, 202-212
ABSTRACT
The vaporization enthalpies and liquid vapor pressures at T/K = 298.15 have been evaluated by correlation gas chromatography for the following fatty acids (?lgHm(298.15 K)/kJ*mol 1; 108*pl298/Pa): (9Z)-hexadecenoic acid (palmitoleic acid) (123.0 +- 6.4); (6900 +- 4200), (6Z)-octadecenoic acid (petroselinic acid), (131.2 +- 2.1); (1130 +- 1000), (9Z)-octadecenoic acid (oleic acid), (132.6 +- 6.6); (1010 +- 600), (5Z,8Z,11Z,14Z)-eicosatetraenoic acid (arachidonic acid), (145.3 +- 6.8); (65 +- 37), (11Z)-eicosenoic acid (gondoic acid), (143.5 +- 2.2); (118 +- 105), (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexenoic acid (cervonic acid), (162.9 +- 2.3); (2.2 +- 2.0), (15Z)-tetracosenoic acid (nervonic acid), (170.6 +- 2.3), (1.0 +- 0.9); n-tetracosanoic acid (lignoceric acid), (170.7 +- 2.3); (1.1 +- 1.0), and n-hexacosanoic acid (cerotic acid, (177.2 +- 2.4); (0.25 +- 0.22). For those fatty acids that are solids at T/K = 298.15, the following fusion temperatures, fusion and sublimation enthalpies, and solid vapor pressures are also reported (Tfus/K; ?crlHm(Tfus)/kJ*mol 1; ?crgHm(298.15 K)/kJ*mol 1; 1010*pcr298/Pa): (15Z)-tetracosenoic acid (315 +- 0.3); (60.3 +- 0.5), (228.9 +- 2.4), 27; tetracosanoic acid (356.5 +- 0.2); (84.5 +- 0.5); (253 +- 3.2), 0.4, hexacosanoic acid (358.8 +- 0.3); (88.5 +- 1.0); (257.8 +- 3.5), 0.08. Vapor pressures of the solids are believed accurate within a factor of 3. Tetracosanoic acid also exhibited phase transitions: T/K = (347 and 351); (4.94 +- 0.1) kJ*mol 1. The phase transition for hexacosanoic at T/K = (354.3 +- 0.1) was not resolved from the fusion peak; the enthalpy is included in the fusion enthalpy. Equations to evaluate liquid vapor pressures for a series of saturated and unsaturated fatty acids from T/K = (298.15 to Tb) are also derived.
Compounds
# Formula Name
1 C16H30O2 cis-9-hexadecenoic acid
2 C18H34O2 (Z)-6-octadecenoic acid
3 C18H34O2 (Z)-9-octadecenoic acid
4 C20H32O2 5,8,11,14-eicosatetraenoic acid
5 C20H38O2 (11Z)-eicosenoic acid
6 C22H32O2 cis-4,7,10,13,16,19-docosahexaenoic acid
7 C24H46O2 (Z)-tetracos-15-enoic acid
8 C24H48O2 lignoceric acid
9 C26H52O2 hexacosanoic acid
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
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 1
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 2
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 2
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 3
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 3
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 4
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 4
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 5
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 5
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 6
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 6
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 7
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 7
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 7
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • DTA
  • 1
  • POMD
  • 7
  • Molar enthalpy of transition or fusion, kJ/mol ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • DSC
  • 1
  • POMD
  • 7
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Crystal
  • Temperature, K; Crystal
  • Crystal
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 7
  • Vapor or sublimation pressure, kPa ; Crystal
  • Temperature, K; Crystal
  • Crystal
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 8
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 8
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 8
  • Normal melting temperature, K ; Crystal 1
  • Crystal 1
  • Liquid
  • Air at 1 atmosphere
  • DTA
  • 1
  • POMD
  • 8
  • Molar enthalpy of transition or fusion, kJ/mol ; Crystal 1
  • Crystal 1
  • Liquid
  • Air at 1 atmosphere
  • DSC
  • 1
  • POMD
  • 8
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Crystal
  • Temperature, K; Crystal
  • Crystal
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 8
  • Vapor or sublimation pressure, kPa ; Crystal
  • Temperature, K; Crystal
  • Crystal
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 8
  • Triple point temperature, K ; Crystal 2
  • Crystal 2
  • Crystal 1
  • Air at 1 atmosphere
  • DTA
  • 1
  • POMD
  • 8
  • Triple point temperature, K ; Crystal 3
  • Crystal 3
  • Crystal 2
  • Air at 1 atmosphere
  • DTA
  • 1
  • POMD
  • 8
  • Molar enthalpy of transition or fusion, kJ/mol ; Crystal 3
  • Crystal 3
  • Crystal 1
  • Air at 1 atmosphere
  • DSC
  • 1
  • POMD
  • 9
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 9
  • Vapor or sublimation pressure, kPa ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 9
  • Normal melting temperature, K ; Crystal 1
  • Crystal 1
  • Liquid
  • Air at 1 atmosphere
  • DTA
  • 1
  • POMD
  • 9
  • Molar enthalpy of transition or fusion, kJ/mol ; Crystal 2
  • Crystal 2
  • Liquid
  • Air at 1 atmosphere
  • DSC
  • 1
  • POMD
  • 9
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Crystal
  • Temperature, K; Crystal
  • Crystal
  • Gas
  • Correlation gas chromatography
  • 1
  • POMD
  • 9
  • Vapor or sublimation pressure, kPa ; Crystal
  • Temperature, K; Crystal
  • Crystal
  • Gas
  • Gas chromatography
  • 1
  • POMD
  • 9
  • Triple point temperature, K ; Crystal 2
  • Crystal 2
  • Crystal 1
  • Air at 1 atmosphere
  • DTA
  • 1