Chemical Properties of L-Valine, N-(3-trifluoromethylbenzoyl)-, nonadecyl ester

L-Valine, N-(3-trifluoromethylbenzoyl)-, nonadecyl ester

InChI
InChI=1S/C32H52F3NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-39-31(38)29(26(2)3)36-30(37)27-22-21-23-28(25-27)32(33,34)35/h21-23,25-26,29H,4-20,24H2,1-3H3,(H,36,37)
InChI Key
RHZTWHIKOHFLOR-UHFFFAOYSA-N
Formula
C32H52F3NO3
SMILES
CCCCCCCCCCCCCCCCCCCOC(=O)C(NC(=O)c1cccc(C(F)(F)F)c1)C(C)C
Molecular Weight1
555.76
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Physical Properties

Property Value Unit Source
ΔfusH° 78.14 kJ/mol Joback Calculated Property
logPoct/wat 9.655 Crippen Calculated Property
McVol 462.280 ml/mol McGowan Calculated Property
Pc 627.19 kPa Joback Calculated Property
Inp [3456.00; 3456.00]   Show Hide
Inp 3456.00 NIST
Inp 3456.00 NIST
Tboil 710.65 K Relay (1.0) Calculated Property
Tfus 367.54 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, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [685.57; 1606.45] 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-2.38120e+01
Coefficient B3.07186e+00
Coefficient C-1.84386e-03
Coefficient D4.02260e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 685.57 J/mol×K 273.00 Calculated Property
Cp,gas 849.98 J/mol×K 353.78 Calculated Property
Cp,gas 995.90 J/mol×K 434.56 Calculated Property
Cp,gas 1124.60 J/mol×K 515.33 Calculated Property
Cp,gas 1237.35 J/mol×K 596.11 Calculated Property
Cp,gas 1335.43 J/mol×K 676.89 Calculated Property
Cp,gas 1420.11 J/mol×K 757.67 Calculated Property
Cp,gas 1492.66 J/mol×K 838.44 Calculated Property
Cp,gas 1554.35 J/mol×K 919.22 Calculated Property
Cp,gas 1606.45 J/mol×K 1000.00 Calculated Property

Similar Compounds

L-Valine, N-(3-trifluoromethylbenzoyl)-, dodecyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, hexyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, pentadecyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, undecyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, tetradecyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, octadecyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, eicosyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, heptyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, nonyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, heptadecyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, tridecyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, decyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, hexadecyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, pentyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, butyl ester.

Find more compounds similar to L-Valine, N-(3-trifluoromethylbenzoyl)-, nonadecyl ester.

Sources

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