Chemical Properties of .beta.-Alanine, N-(2,6-difluorobenzoyl)-, pentadecyl ester

.beta.-Alanine, N-(2,6-difluorobenzoyl)-, pentadecyl ester

InChI
InChI=1S/C25H39F2NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-31-23(29)18-19-28-25(30)24-21(26)16-15-17-22(24)27/h15-17H,2-14,18-20H2,1H3,(H,28,30)
InChI Key
LURMHQOIYFPPNG-UHFFFAOYSA-N
Formula
C25H39F2NO3
SMILES
CCCCCCCCCCCCCCCOC(=O)CCNC(=O)c1c(F)cccc1F
Molecular Weight1
439.59
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Physical Properties

Property Value Unit Source
ΔfusH° 71.00 kJ/mol Joback Calculated Property
ΔvapH° 129.97 kJ/mol Relay (1.0) Calculated Property
log10WS -7.39 Relay (1.0) Calculated Property
logPoct/wat 6.719 Crippen Calculated Property
McVol 361.880 ml/mol McGowan Calculated Property
Pc 903.97 kPa Joback Calculated Property
Tboil 677.29 K Relay (1.0) Calculated Property
Tfus 347.21 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation 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 [1218.26; 1299.05] J/mol×K [969.04; 1188.62] Show Hide
Cp,gas 1218.26 J/mol×K 969.04 Joback Calculated Property
Cp,gas 1235.16 J/mol×K 1005.64 Joback Calculated Property
Cp,gas 1250.60 J/mol×K 1042.23 Joback Calculated Property
Cp,gas 1264.65 J/mol×K 1078.83 Joback Calculated Property
Cp,gas 1277.36 J/mol×K 1115.43 Joback Calculated Property
Cp,gas 1288.81 J/mol×K 1152.03 Joback Calculated Property
Cp,gas 1299.05 J/mol×K 1188.62 Joback Calculated Property

Similar Compounds

«beta»-Alanine, N-(2,6-difluorobenzoyl)-, undecyl ester. .beta.-Alanine, N-(2,6-difluorobenzoyl)-, dodecyl ester. «beta»- Alanine, N-(2,6-difluorobenzoyl)-, tetradecyl ester. .beta.-Alanine, N-(2,6-difluorobenzoyl)-, heptyl ester. .beta.-Alanine, N-(2,6-difluorobenzoyl)-, octyl ester. «beta»-Alanine, N-(2,6-difluorobenzoyl)-, nonyl ester. .beta.-Alanine, N-(2,6-difluorobenzoyl)-, decyl ester. «beta»-Alanine, N-(2,6-difluorobenzoyl)-, hexyl ester. .beta.-Alanine, N-(2,6-difluorobenzoyl)-, pentyl ester. «beta»-Alanine, N-(2,6-difluorobenzoyl)-, isohexyl ester. .beta.-Alanine, N-(2,6-difluorobenzoyl)-, butyl ester. «beta»-Alanine, N-(2,3,4-trifluorobenzoyl)-, dodecyl ester. «beta»-Alanine, N-(2,3,4-trifluorobenzoyl)-, tetradecyl ester. «beta»-Alanine, N-(2,3,4-trifluorobenzoyl)-, octyl ester. .beta.-Alanine, N-(2,3,4-trifluorobenzoyl)-, decyl ester.

Find more compounds similar to .beta.-Alanine, N-(2,6-difluorobenzoyl)-, pentadecyl ester.

Sources

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