Chemical Properties of L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, isohexyl ester

L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, isohexyl ester

InChI
InChI=1S/C19H25F4NO3/c1-11(2)7-6-10-27-18(26)16(12(3)4)24-17(25)13-8-5-9-14(15(13)20)19(21,22)23/h5,8-9,11-12,16H,6-7,10H2,1-4H3,(H,24,25)
InChI Key
LMGVXSICSIWZFO-UHFFFAOYSA-N
Formula
C19H25F4NO3
SMILES
CC(C)CCCOC(=O)C(NC(=O)c1cccc(C(F)(F)F)c1F)C(C)C
Molecular Weight1
391.40
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Physical Properties

Property Value Unit Source
ΔfusH° 43.63 kJ/mol Joback Calculated Property
log10WS -5.60 Relay (1.0) Calculated Property
logPoct/wat 4.578 Crippen Calculated Property
McVol 280.880 ml/mol McGowan Calculated Property
Inp [2107.00; 2107.00]   Show Hide
Inp 2107.00 NIST
Inp 2107.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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 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 [874.54; 946.22] J/mol×K [825.75; 1020.19] Show Hide
Cp,gas 874.54 J/mol×K 825.75 Joback Calculated Property
Cp,gas 888.97 J/mol×K 858.16 Joback Calculated Property
Cp,gas 902.35 J/mol×K 890.56 Joback Calculated Property
Cp,gas 914.72 J/mol×K 922.97 Joback Calculated Property
Cp,gas 926.12 J/mol×K 955.37 Joback Calculated Property
Cp,gas 936.61 J/mol×K 987.78 Joback Calculated Property
Cp,gas 946.22 J/mol×K 1020.19 Joback Calculated Property

Similar Compounds

L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, undecyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, pentadecyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, octadecyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, hexyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, heptadecyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, dodecyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, decyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, nonyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, octyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, heptyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, tetradecyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, hexadecyl ester. L-Valine, N-(2-fluoro-5-trifluoromethylbenzoyl)-, isohexyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, isobutyl ester. L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, propyl ester.

Find more compounds similar to L-Valine, N-(2-fluoro-3-trifluoromethylbenzoyl)-, isohexyl ester.

Sources

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