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

A Comparison of Results by Correlation Gas Chromatography with Another Gas Chromatographic Retention Time Technique. The Effects of Retention Time Coincidence on Vaporization Enthalpy and Vapor Pressure

Gobble, C., Chickos, J. S.
J. Chem. Eng. Data 2015, 60, 9, 2739-2748
ABSTRACT
The vaporization enthalpies of a mixture of n-alkanes, aliphatic esters, and dialkyl phthalates are examined both by correlation gas chromatography and another commonly used gas chromatographic retention time technique according to the protocol described by Hamilton. The resulting vaporization enthalpies and vapor pressures at T/K = 298.15 are compared with respect to the functional groups present. Additionally, two compounds, docosane and ethyl octadecanoate, exhibited retention time coincidence over a T/K = 30 temperature range. These compounds have been examined by correlation gas chromatography to determine how this coincidence affects the thermochemical properties evaluated.
Compounds
# Formula Name
1 C10H10O4 dimethyl 1,2-benzenedicarboxylate
2 C12H14O4 diethyl phthalate
3 C16H22O4 dibutyl phthalate
4 C17H34O2 methyl hexadecanoate
5 C19H20O4 benzyl butyl 1,2-benzenedioate
6 C19H38O2 methyl octadecanoate
7 C20H40O2 ethyl octadecanoate
8 C20H42 eicosane
9 C21H42O2 methyl eicosanoate
10 C22H44O2 methyl heneicosanoate
11 C22H46 docosane
12 C24H38O4 bis(2-ethylhexyl) 1,2-benzenedicarboxylate
13 C24H38O4 dioctyl 1,2-benzenedicarboxylate
14 C24H50 tetracosane
15 C25H52 pentacosane
16 C26H54 hexacosane
17 C28H58 octacosane
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
  • Chromatographic retention time
  • 1
  • POMD
  • 1
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 2
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 2
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 3
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 3
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 4
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 4
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 5
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 5
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 6
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 7
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 7
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 8
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 8
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 9
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 10
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 10
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 11
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 11
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 12
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 12
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 13
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 13
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 14
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 14
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 15
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 15
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 16
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 16
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1
  • POMD
  • 17
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Chromatographic retention time
  • 1
  • POMD
  • 17
  • Molar enthalpy of vaporization or sublimation, kJ/mol ; Liquid
  • Temperature, K; Liquid
  • Liquid
  • Gas
  • Correlation-gas chromatography
  • 1