Chemical Properties of Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, tridecyl ester

Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, tridecyl ester

InChI
InChI=1S/C27H39F6NO3/c1-2-3-4-5-6-7-8-9-10-11-12-16-37-25(36)15-13-14-24(35)34-20-21-17-22(26(28,29)30)19-23(18-21)27(31,32)33/h17-19H,2-16,20H2,1H3,(H,34,35)
InChI Key
BUPGDKPBZNVDCX-UHFFFAOYSA-N
Formula
C27H39F6NO3
SMILES
CCCCCCCCCCCCCOC(=O)CCCC(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1
Molecular Weight1
539.59
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Physical Properties

Property Value Unit Source
ΔfusH° 73.67 kJ/mol Joback Calculated Property
ΔvapH° 131.46 kJ/mol Relay (1.0) Calculated Property
log10WS -8.17 Relay (1.0) Calculated Property
logPoct/wat 8.365 Crippen Calculated Property
McVol 397.140 ml/mol McGowan Calculated Property
Inp 2970.00 NIST
Tboil 696.24 K Relay (1.0) Calculated Property
Tfus 379.22 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [605.82; 1367.06] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-7.80400e+00
Coefficient B2.68672e+00
Coefficient C-1.71942e-03
Coefficient D4.07560e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 605.82 J/mol×K 273.00 Calculated Property
Cp,gas 745.54 J/mol×K 353.78 Calculated Property
Cp,gas 868.48 J/mol×K 434.56 Calculated Property
Cp,gas 975.91 J/mol×K 515.33 Calculated Property
Cp,gas 1069.12 J/mol×K 596.11 Calculated Property
Cp,gas 1149.40 J/mol×K 676.89 Calculated Property
Cp,gas 1218.05 J/mol×K 757.67 Calculated Property
Cp,gas 1276.35 J/mol×K 838.44 Calculated Property
Cp,gas 1325.59 J/mol×K 919.22 Calculated Property
Cp,gas 1367.06 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, hexadecyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, decyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, dodecyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, heptyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, octyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, undecyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, octadecyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, pentadecyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, pentyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, isohexyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, butyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, propyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, isobutyl ester. Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, ethyl ester. Glutaric acid, monoamide, N-(4-methylbenzyl)-, tetradecyl ester.

Find more compounds similar to Glutaric acid, monoamide, N-(3,5-di(trifluoromethyl)benzyl)-, tridecyl ester.

Sources

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