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

L-Valine, N-(2-fluoro-5-trifluoromethylbenzoyl)-, hexadecyl ester

InChI
InChI=1S/C29H45F4NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-37-28(36)26(22(2)3)34-27(35)24-21-23(29(31,32)33)18-19-25(24)30/h18-19,21-22,26H,4-17,20H2,1-3H3,(H,34,35)
InChI Key
MSWRXUWPVBTZOG-UHFFFAOYSA-N
Formula
C29H45F4NO3
SMILES
CCCCCCCCCCCCCCCCOC(=O)C(NC(=O)c1cc(C(F)(F)F)ccc1F)C(C)C
Molecular Weight1
531.67
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Physical Properties

Property Value Unit Source
ΔfusH° 71.47 kJ/mol Joback Calculated Property
logPoct/wat 8.623 Crippen Calculated Property
McVol 421.780 ml/mol McGowan Calculated Property
Inp [3138.00; 3138.00]   Show Hide
Inp 3138.00 NIST
Inp 3138.00 NIST
Tboil 686.53 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 [1491.15; 1582.85] J/mol×K [1072.86; 1335.87] Show Hide
Cp,gas 1491.15 J/mol×K 1072.86 Joback Calculated Property
Cp,gas 1510.22 J/mol×K 1116.69 Joback Calculated Property
Cp,gas 1527.55 J/mol×K 1160.53 Joback Calculated Property
Cp,gas 1543.30 J/mol×K 1204.36 Joback Calculated Property
Cp,gas 1557.66 J/mol×K 1248.20 Joback Calculated Property
Cp,gas 1570.78 J/mol×K 1292.03 Joback Calculated Property
Cp,gas 1582.85 J/mol×K 1335.87 Joback Calculated Property

Similar Compounds

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

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

Sources

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