Chemical Properties of L-Valine, N-(3-chloro-2-fluorobenzoyl)-, undecyl ester

L-Valine, N-(3-chloro-2-fluorobenzoyl)-, undecyl ester

InChI
InChI=1S/C23H35ClFNO3/c1-4-5-6-7-8-9-10-11-12-16-29-23(28)21(17(2)3)26-22(27)18-14-13-15-19(24)20(18)25/h13-15,17,21H,4-12,16H2,1-3H3,(H,26,27)
InChI Key
IWDFXPNAANJEFZ-UHFFFAOYSA-N
Formula
C23H35ClFNO3
SMILES
CCCCCCCCCCCOC(=O)C(NC(=O)c1cccc(Cl)c1F)C(C)C
Molecular Weight1
427.98
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Physical Properties

Property Value Unit Source
ΔfusH° 58.30 kJ/mol Joback Calculated Property
log10WS -7.09 Relay (1.0) Calculated Property
logPoct/wat 6.308 Crippen Calculated Property
McVol 344.170 ml/mol McGowan Calculated Property
Pc 1061.71 kPa Joback Calculated Property
Inp [2922.00; 2922.00]   Show Hide
Inp 2922.00 NIST
Inp 2922.00 NIST
Tboil 651.32 K Relay (1.0) Calculated Property
Tfus 370.48 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, 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 [1122.07; 1194.36] J/mol×K [978.43; 1197.94] Show Hide
Cp,gas 1122.07 J/mol×K 978.43 Joback Calculated Property
Cp,gas 1137.22 J/mol×K 1015.02 Joback Calculated Property
Cp,gas 1151.05 J/mol×K 1051.60 Joback Calculated Property
Cp,gas 1163.63 J/mol×K 1088.19 Joback Calculated Property
Cp,gas 1175.00 J/mol×K 1124.77 Joback Calculated Property
Cp,gas 1185.23 J/mol×K 1161.36 Joback Calculated Property
Cp,gas 1194.36 J/mol×K 1197.94 Joback Calculated Property

Similar Compounds

L-Valine, N-(3-chloro-2-fluorobenzoyl)-, hexadecyl ester. L-Valine, N-(3-chloro-2-fluorobenzoyl)-, pentadecyl ester. L-Valine, N-(3-chloro-2-fluorobenzoyl)-, decyl ester. L-Valine, N-(3-chloro-2-fluorobenzoyl)-, heptadecyl ester. L-Valine, N-(3-chloro-2-fluorobenzoyl)-, tetradecyl ester. L-Valine, N-(2,4-difluorobenzoyl)-, octadecyl ester. L-Valine, N-(2,4-difluorobenzoyl)-, dodecyl ester. L-Valine, N-(2,4-difluorobenzoyl)-, heptadecyl ester. L-Valine, N-(2,4-difluorobenzoyl)-, tetradecyl ester. L-Valine, N-(2,4-difluorobenzoyl)-, undecyl ester. L-Valine, N-(2,4-difluorobenzoyl)-, pentadecyl ester. L-Valine, N-(2,4-difluorobenzoyl)-, hexadecyl ester. L-Valine, N-(2,5-difluorobenzoyl)-, pentadecyl ester. L-Valine, N-(2,5-difluorobenzoyl)-, tetradecyl ester. L-Valine, N-(2,5-difluorobenzoyl)-, heptadecyl ester.

Find more compounds similar to L-Valine, N-(3-chloro-2-fluorobenzoyl)-, undecyl ester.

Sources

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