Chemical Properties of D-Alanine, N-(3,4-difluorobenzoyl)-, pentadecyl ester

D-Alanine, N-(3,4-difluorobenzoyl)-, pentadecyl ester

InChI
InChI=1S/C25H39F2NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-31-25(30)20(2)28-24(29)21-16-17-22(26)23(27)19-21/h16-17,19-20H,3-15,18H2,1-2H3,(H,28,29)
InChI Key
KEYUFLIXDIBWST-UHFFFAOYSA-N
Formula
C25H39F2NO3
SMILES
CCCCCCCCCCCCCCCOC(=O)C(C)NC(=O)c1ccc(F)c(F)c1
Molecular Weight1
439.58
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Physical Properties

Property Value Unit Source
ΔfusH° 67.47 kJ/mol Joback Calculated Property
log10WS -7.39 Relay (1.0) Calculated Property
logPoct/wat 6.718 Crippen Calculated Property
McVol 361.880 ml/mol McGowan Calculated Property
Pc 908.34 kPa Joback Calculated Property
Inp [3040.00; 3040.00]   Show Hide
Inp 3040.00 NIST
Inp 3040.00 NIST
Tboil 662.49 K Relay (1.0) Calculated Property
Tfus 341.95 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 [1218.64; 1298.71] J/mol×K [968.60; 1187.33] Show Hide
Cp,gas 1218.64 J/mol×K 968.60 Joback Calculated Property
Cp,gas 1235.43 J/mol×K 1005.05 Joback Calculated Property
Cp,gas 1250.76 J/mol×K 1041.51 Joback Calculated Property
Cp,gas 1264.69 J/mol×K 1077.96 Joback Calculated Property
Cp,gas 1277.28 J/mol×K 1114.42 Joback Calculated Property
Cp,gas 1288.60 J/mol×K 1150.87 Joback Calculated Property
Cp,gas 1298.71 J/mol×K 1187.33 Joback Calculated Property

Similar Compounds

D-Alanine, N-(3,4-difluorobenzoyl)-, octadecyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, hexadecyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, eicosyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, nonyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, tridecyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, octyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, dodecyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, hexyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, undecyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, tetradecyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, decyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, pentyl ester. D-Alanine, N-(3,4-difluorobenzoyl)-, butyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, heptadecyl ester. D-Alanine, N-(2,4-difluorobenzoyl)-, nonadecyl ester.

Find more compounds similar to D-Alanine, N-(3,4-difluorobenzoyl)-, pentadecyl ester.

Sources

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