Chemical Properties of L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexyl ester

L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexyl ester

InChI
InChI=1S/C20H25F6NO3/c1-4-5-6-7-10-30-18(29)16(12(2)3)27-17(28)14-11-13(19(21,22)23)8-9-15(14)20(24,25)26/h8-9,11-12,16H,4-7,10H2,1-3H3,(H,27,28)
InChI Key
NQHZAVWETNFRGM-UHFFFAOYSA-N
Formula
C20H25F6NO3
SMILES
CCCCCCOC(=O)C(NC(=O)c1cc(C(F)(F)F)ccc1C(F)(F)F)C(C)C
Molecular Weight1
441.41
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Physical Properties

Property Value Unit Source
ΔfusH° 48.49 kJ/mol Joback Calculated Property
logPoct/wat 5.602 Crippen Calculated Property
McVol 298.510 ml/mol McGowan Calculated Property
Inp [2063.00; 2063.00]   Show Hide
Inp 2063.00 NIST
Inp 2063.00 NIST
Tboil 607.87 K Relay (1.0) Calculated Property

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [456.69; 1007.00] 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-4.80500e+00
Coefficient B2.03356e+00
Coefficient C-1.34502e-03
Coefficient D3.23260e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 456.69 J/mol×K 273.00 Calculated Property
Cp,gas 560.60 J/mol×K 353.78 Calculated Property
Cp,gas 651.43 J/mol×K 434.56 Calculated Property
Cp,gas 730.20 J/mol×K 515.33 Calculated Property
Cp,gas 797.95 J/mol×K 596.11 Calculated Property
Cp,gas 855.68 J/mol×K 676.89 Calculated Property
Cp,gas 904.44 J/mol×K 757.67 Calculated Property
Cp,gas 945.22 J/mol×K 838.44 Calculated Property
Cp,gas 979.07 J/mol×K 919.22 Calculated Property
Cp,gas 1006.99 J/mol×K 1000.00 Calculated Property

Similar Compounds

L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, heptadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, decyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, octyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, heptyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, octadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, pentadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, undecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, dodecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, tetradecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, pentyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, butyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, isohexyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, propyl ester. L-Valine, N-(2-trifluoromethylbenzoyl)-, pentadecyl ester.

Find more compounds similar to L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexyl ester.

Sources

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