Chemical Properties of L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, heptyl ester

L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, heptyl ester

InChI
InChI=1S/C20H27F4NO3/c1-4-5-6-7-8-11-28-19(27)17(13(2)3)25-18(26)14-9-10-15(16(21)12-14)20(22,23)24/h9-10,12-13,17H,4-8,11H2,1-3H3,(H,25,26)
InChI Key
QTGIMUPMJGCRRY-UHFFFAOYSA-N
Formula
C20H27F4NO3
SMILES
CCCCCCCOC(=O)C(NC(=O)c1ccc(C(F)(F)F)c(F)c1)C(C)C
Molecular Weight1
405.43
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Physical Properties

Property Value Unit Source
ΔfusH° 48.16 kJ/mol Joback Calculated Property
logPoct/wat 5.113 Crippen Calculated Property
McVol 294.970 ml/mol McGowan Calculated Property
Inp [2172.00; 2172.00]   Show Hide
Inp 2172.00 NIST
Inp 2172.00 NIST
Tboil 620.97 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, 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 [938.18; 1011.09] J/mol×K [866.94; 1065.05] Show Hide
Cp,gas 938.18 J/mol×K 866.94 Joback Calculated Property
Cp,gas 952.76 J/mol×K 899.96 Joback Calculated Property
Cp,gas 966.29 J/mol×K 932.98 Joback Calculated Property
Cp,gas 978.85 J/mol×K 966.00 Joback Calculated Property
Cp,gas 990.46 J/mol×K 999.02 Joback Calculated Property
Cp,gas 1001.20 J/mol×K 1032.04 Joback Calculated Property
Cp,gas 1011.09 J/mol×K 1065.05 Joback Calculated Property

Similar Compounds

L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, decyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, nonyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, pentadecyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, tetradecyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, hexadecyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, dodecyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, octadecyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, hexyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, heptadecyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, undecyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, octyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, pentyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, butyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, isohexyl ester. L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, propyl ester.

Find more compounds similar to L-Valine, N-(3-fluoro-4-trifluoromethylbenzoyl)-, heptyl ester.

Sources

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