Chemical Properties of L-Valine, N-(4-fluorobenzoyl)-, undecyl ester

L-Valine, N-(4-fluorobenzoyl)-, undecyl ester

InChI
InChI=1S/C23H36FNO3/c1-4-5-6-7-8-9-10-11-12-17-28-23(27)21(18(2)3)25-22(26)19-13-15-20(24)16-14-19/h13-16,18,21H,4-12,17H2,1-3H3,(H,25,26)
InChI Key
ZVPGTMSTFBKXGT-UHFFFAOYSA-N
Formula
C23H36FNO3
SMILES
CCCCCCCCCCCOC(=O)C(NC(=O)c1ccc(F)cc1)C(C)C
Molecular Weight1
393.54
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Physical Properties

Property Value Unit Source
ΔfusH° 56.08 kJ/mol Joback Calculated Property
log10WS -6.50 Relay (1.0) Calculated Property
logPoct/wat 5.654 Crippen Calculated Property
McVol 331.930 ml/mol McGowan Calculated Property
Pc 1069.36 kPa Joback Calculated Property
Inp [2740.00; 2740.00]   Show Hide
Inp 2740.00 NIST
Inp 2740.00 NIST
Tboil 649.43 K Relay (1.0) Calculated Property
Tfus 353.84 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [479.71; 1126.52] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-3.34000e+00
Coefficient B2.06746e+00
Coefficient C-1.14966e-03
Coefficient D2.12060e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 479.71 J/mol×K 273.00 Calculated Property
Cp,gas 593.58 J/mol×K 353.78 Calculated Property
Cp,gas 695.39 J/mol×K 434.56 Calculated Property
Cp,gas 785.80 J/mol×K 515.33 Calculated Property
Cp,gas 865.49 J/mol×K 596.11 Calculated Property
Cp,gas 935.12 J/mol×K 676.89 Calculated Property
Cp,gas 995.37 J/mol×K 757.67 Calculated Property
Cp,gas 1046.90 J/mol×K 838.44 Calculated Property
Cp,gas 1090.40 J/mol×K 919.22 Calculated Property
Cp,gas 1126.52 J/mol×K 1000.00 Calculated Property

Similar Compounds

L-Valine, N-(4-fluorobenzoyl)-, heptadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, dodecyl ester. L-Valine, N-(4-fluorobenzoyl)-, hexyl ester. L-Valine, N-(4-fluorobenzoyl)-, octadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, heptyl ester. L-Valine, N-(4-fluorobenzoyl)-, nonyl ester. L-Valine, N-(4-fluorobenzoyl)-, hexadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, tetradecyl ester. L-Valine, N-(4-fluorobenzoyl)-, octyl ester. L-Valine, N-(4-fluorobenzoyl)-, pentadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, decyl ester. L-Valine, N-(4-fluorobenzoyl)-, pentyl ester. L-Valine, N-(4-fluorobenzoyl)-, butyl ester. L-Valine, N-(3,4-difluorobenzoyl)-, octyl ester. L-Valine, N-(3,4-difluorobenzoyl)-, octadecyl ester.

Find more compounds similar to L-Valine, N-(4-fluorobenzoyl)-, undecyl ester.

Sources

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