Chemical Properties of L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexadecyl ester

L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexadecyl ester

InChI
InChI=1S/C30H45F6NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-40-28(39)26(22(2)3)37-27(38)24-21-23(29(31,32)33)18-19-25(24)30(34,35)36/h18-19,21-22,26H,4-17,20H2,1-3H3,(H,37,38)
InChI Key
XOVFPYVKOAZFEQ-UHFFFAOYSA-N
Formula
C30H45F6NO3
SMILES
CCCCCCCCCCCCCCCCOC(=O)C(NC(=O)c1cc(C(F)(F)F)ccc1C(F)(F)F)C(C)C
Molecular Weight1
581.67
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Physical Properties

Property Value Unit Source
ΔfusH° 72.81 kJ/mol Joback Calculated Property
logPoct/wat 9.503 Crippen Calculated Property
McVol 439.410 ml/mol McGowan Calculated Property
Inp [3024.00; 3024.00]   Show Hide
Inp 3024.00 NIST
Inp 3024.00 NIST
Tboil 691.44 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 [1567.81; 1671.89] J/mol×K [1091.05; 1371.49] Show Hide
Cp,gas 1567.81 J/mol×K 1091.05 Joback Calculated Property
Cp,gas 1588.28 J/mol×K 1137.79 Joback Calculated Property
Cp,gas 1607.14 J/mol×K 1184.53 Joback Calculated Property
Cp,gas 1624.67 J/mol×K 1231.27 Joback Calculated Property
Cp,gas 1641.13 J/mol×K 1278.01 Joback Calculated Property
Cp,gas 1656.78 J/mol×K 1324.75 Joback Calculated Property
Cp,gas 1671.89 J/mol×K 1371.49 Joback Calculated Property

Similar Compounds

L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, heptadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, decyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, octyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, heptyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, octadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, pentadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, undecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, dodecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, tetradecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, pentyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, butyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, isohexyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, propyl ester. L-Valine, N-(2-trifluoromethylbenzoyl)-, pentadecyl ester.

Find more compounds similar to L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexadecyl ester.

Sources

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