Chemical Properties of Glutaric acid, monoamide, N-butyl-N-phenyl-, isohexyl ester

Glutaric acid, monoamide, N-butyl-N-phenyl-, isohexyl ester

InChI
InChI=1S/C21H33NO3/c1-4-5-16-22(19-12-7-6-8-13-19)20(23)14-9-15-21(24)25-17-10-11-18(2)3/h6-8,12-13,18H,4-5,9-11,14-17H2,1-3H3
InChI Key
UNZMNTWNFFWOKX-UHFFFAOYSA-N
Formula
C21H33NO3
SMILES
CCCCN(C(=O)CCCC(=O)OCCCC(C)C)c1ccccc1
Molecular Weight1
347.49
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Physical Properties

Property Value Unit Source
ΔfusH° 49.65 kJ/mol Joback Calculated Property
logPoct/wat 4.969 Crippen Calculated Property
McVol 301.980 ml/mol McGowan Calculated Property
Inp [2504.00; 2504.00]   Show Hide
Inp 2504.00 NIST
Inp 2504.00 NIST
Tboil 653.85 K Relay (1.0) Calculated Property
Tfus 310.59 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [943.85; 1030.07] J/mol×K [830.85; 1028.66] Show Hide
Cp,gas 943.85 J/mol×K 830.85 Joback Calculated Property
Cp,gas 961.01 J/mol×K 863.82 Joback Calculated Property
Cp,gas 976.98 J/mol×K 896.79 Joback Calculated Property
Cp,gas 991.82 J/mol×K 929.75 Joback Calculated Property
Cp,gas 1005.58 J/mol×K 962.72 Joback Calculated Property
Cp,gas 1018.32 J/mol×K 995.69 Joback Calculated Property
Cp,gas 1030.07 J/mol×K 1028.66 Joback Calculated Property

Similar Compounds

Glutaric acid, monoamide, N-butyl-N-phenyl-, pentyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, pentadecyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, decyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, heptyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, tetradecyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, nonyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, dodecyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, tridecyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, octadecyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, octyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, hexyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, butyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, propyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, isobutyl ester. Glutaric acid, monoamide, N-butyl-N-phenyl-, ethyl ester.

Find more compounds similar to Glutaric acid, monoamide, N-butyl-N-phenyl-, isohexyl ester.

Sources

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