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

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

InChI
InChI=1S/C20H29F2NO3/c1-2-3-4-5-6-7-8-9-15-26-18(24)13-14-23-20(25)19-16(21)11-10-12-17(19)22/h10-12H,2-9,13-15H2,1H3,(H,23,25)
InChI Key
AOJOMIAVCWRIEW-UHFFFAOYSA-N
Formula
C20H29F2NO3
SMILES
CCCCCCCCCCOC(=O)CCNC(=O)c1c(F)cccc1F
Molecular Weight1
369.45
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Physical Properties

Property Value Unit Source
ΔfusH° 58.05 kJ/mol Joback Calculated Property
ΔvapH° 110.09 kJ/mol Relay (1.0) Calculated Property
log10WS -6.03 Relay (1.0) Calculated Property
logPoct/wat 4.769 Crippen Calculated Property
McVol 291.430 ml/mol McGowan Calculated Property
Pc 1234.61 kPa Joback Calculated Property
Inp [2686.00; 2686.00]   Show Hide
Inp 2686.00 NIST
Inp 2686.00 NIST
Tboil 643.16 K Relay (1.0) Calculated Property
Tfus 337.35 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 [915.43; 990.57] J/mol×K [854.64; 1050.24] Show Hide
Cp,gas 915.43 J/mol×K 854.64 Joback Calculated Property
Cp,gas 930.54 J/mol×K 887.24 Joback Calculated Property
Cp,gas 944.58 J/mol×K 919.84 Joback Calculated Property
Cp,gas 957.57 J/mol×K 952.44 Joback Calculated Property
Cp,gas 969.54 J/mol×K 985.04 Joback Calculated Property
Cp,gas 980.53 J/mol×K 1017.64 Joback Calculated Property
Cp,gas 990.57 J/mol×K 1050.24 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)-, pentadecyl 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)-, decyl ester.

Sources

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