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

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

InChI
InChI=1S/C21H27F6NO3/c1-2-3-4-5-6-10-31-19(30)9-7-8-18(29)28-14-15-11-16(20(22,23)24)13-17(12-15)21(25,26)27/h11-13H,2-10,14H2,1H3,(H,28,29)
InChI Key
TVXDZLVUAQGOES-UHFFFAOYSA-N
Formula
C21H27F6NO3
SMILES
CCCCCCCOC(=O)CCCC(=O)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1
Molecular Weight1
455.43
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 58.13 kJ/mol Joback Calculated Property
ΔvapH° 107.26 kJ/mol Relay (1.0) Calculated Property
log10WS -6.47 Relay (1.0) Calculated Property
logPoct/wat 6.024 Crippen Calculated Property
McVol 312.600 ml/mol McGowan Calculated Property
Inp 2402.00 NIST
Tboil 646.77 K Relay (1.0) Calculated Property
Tfus 375.19 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1005.33; 1077.49] J/mol×K [868.14; 1063.19] Show Hide
Cp,gas 1005.33 J/mol×K 868.14 Joback Calculated Property
Cp,gas 1019.69 J/mol×K 900.65 Joback Calculated Property
Cp,gas 1033.02 J/mol×K 933.16 Joback Calculated Property
Cp,gas 1045.40 J/mol×K 965.67 Joback Calculated Property
Cp,gas 1056.89 J/mol×K 998.18 Joback Calculated Property
Cp,gas 1067.56 J/mol×K 1030.68 Joback Calculated Property
Cp,gas 1077.49 J/mol×K 1063.19 Joback Calculated Property

Similar Compounds

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

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.