Chemical Properties of «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, decyl ester

«beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, decyl ester

InChI
InChI=1S/C21H30F3NO3/c1-2-3-4-5-6-7-8-9-16-28-19(26)14-15-25-20(27)17-10-12-18(13-11-17)21(22,23)24/h10-13H,2-9,14-16H2,1H3,(H,25,27)
InChI Key
ODMUXELDHHUTSA-UHFFFAOYSA-N
Formula
C21H30F3NO3
SMILES
CCCCCCCCCCOC(=O)CCNC(=O)c1ccc(C(F)(F)F)cc1
Molecular Weight1
401.46
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Physical Properties

Property Value Unit Source
ΔfusH° 56.69 kJ/mol Joback Calculated Property
ΔvapH° 112.56 kJ/mol Relay (1.0) Calculated Property
log10WS -6.14 Relay (1.0) Calculated Property
logPoct/wat 5.509 Crippen Calculated Property
McVol 307.290 ml/mol McGowan Calculated Property
Pc 1146.76 kPa Joback Calculated Property
Inp [2614.00; 2614.00]   Show Hide
Inp 2614.00 NIST
Inp 2614.00 NIST
Tboil 658.82 K Relay (1.0) Calculated Property
Tfus 349.43 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 [983.44; 1059.43] J/mol×K [868.58; 1065.85] Show Hide
Cp,gas 983.44 J/mol×K 868.58 Joback Calculated Property
Cp,gas 998.63 J/mol×K 901.46 Joback Calculated Property
Cp,gas 1012.73 J/mol×K 934.34 Joback Calculated Property
Cp,gas 1025.80 J/mol×K 967.22 Joback Calculated Property
Cp,gas 1037.91 J/mol×K 1000.10 Joback Calculated Property
Cp,gas 1049.09 J/mol×K 1032.98 Joback Calculated Property
Cp,gas 1059.43 J/mol×K 1065.85 Joback Calculated Property

Similar Compounds

«beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, hexadecyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, nonyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, undecyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, octyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, pentadecyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, heptyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, tetradecyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, dodecyl ester. .beta.-Alanine, N-(4-trifluoromethylbenzoyl)-, hexyl ester. .beta.-Alanine, N-(4-trifluoromethylbenzoyl)-, pentyl ester. «beta»-Alanine, N-(4-methylbenzoyl)-, nonyl ester. .beta.-Alanine, N-(4-methylbezoyl)-, tetradecyl ester. «beta»-Alanine, N-(4-methylbenzoyl)-, heptyl ester. .beta.-Alanine, N-(4-methylbenzoyl)-, decyl ester. .beta.-Alanine, N-(4-methylbenzoyl)-, dodecyl ester.

Find more compounds similar to «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, decyl ester.

Sources

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