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

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

InChI
InChI=1S/C30H50FNO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-35-30(34)28(25(2)3)32-29(33)26-20-22-27(31)23-21-26/h20-23,25,28H,4-19,24H2,1-3H3,(H,32,33)
InChI Key
FKUIILACOJINNC-UHFFFAOYSA-N
Formula
C30H50FNO3
SMILES
CCCCCCCCCCCCCCCCCCOC(=O)C(NC(=O)c1ccc(F)cc1)C(C)C
Molecular Weight1
491.72
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Physical Properties

Property Value Unit Source
ΔfusH° 74.21 kJ/mol Joback Calculated Property
log10WS -8.46 Relay (1.0) Calculated Property
logPoct/wat 8.385 Crippen Calculated Property
McVol 430.560 ml/mol McGowan Calculated Property
Pc 718.76 kPa Joback Calculated Property
Inp [3459.00; 3459.00]   Show Hide
Inp 3459.00 NIST
Inp 3459.00 NIST
Tboil 697.48 K Relay (1.0) Calculated Property
Tfus 362.39 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 [628.20; 1487.66] 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-9.70300e+00
Coefficient B2.73246e+00
Coefficient C-1.53046e-03
Coefficient D2.95360e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 628.20 J/mol×K 273.00 Calculated Property
Cp,gas 778.51 J/mol×K 353.78 Calculated Property
Cp,gas 912.93 J/mol×K 434.56 Calculated Property
Cp,gas 1032.40 J/mol×K 515.33 Calculated Property
Cp,gas 1137.87 J/mol×K 596.11 Calculated Property
Cp,gas 1230.25 J/mol×K 676.89 Calculated Property
Cp,gas 1310.48 J/mol×K 757.67 Calculated Property
Cp,gas 1379.51 J/mol×K 838.44 Calculated Property
Cp,gas 1438.25 J/mol×K 919.22 Calculated Property
Cp,gas 1487.66 J/mol×K 1000.00 Calculated Property

Similar Compounds

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

Sources

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