Chemical Properties of .beta.-Alanine, N-(4-trifluoromethylbenzoyl)-, propyl ester

.beta.-Alanine, N-(4-trifluoromethylbenzoyl)-, propyl ester

InChI
InChI=1S/C14H16F3NO3/c1-2-9-21-12(19)7-8-18-13(20)10-3-5-11(6-4-10)14(15,16)17/h3-6H,2,7-9H2,1H3,(H,18,20)
InChI Key
FLZAOZKNARYWDO-UHFFFAOYSA-N
Formula
C14H16F3NO3
SMILES
CCCOC(=O)CCNC(=O)c1ccc(C(F)(F)F)cc1
Molecular Weight1
303.28
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Physical Properties

Property Value Unit Source
ΔfusH° 38.56 kJ/mol Joback Calculated Property
log10WS -3.77 Relay (1.0) Calculated Property
logPoct/wat 2.778 Crippen Calculated Property
McVol 208.660 ml/mol McGowan Calculated Property
Pc 1921.98 kPa Joback Calculated Property
Inp [1921.00; 1921.00]   Show Hide
Inp 1921.00 NIST
Inp 1921.00 NIST
Tboil 595.65 K Relay (1.0) Calculated Property
Tc 793.98 K Relay (1.0) Calculated Property
Tfus 353.50 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [588.79; 653.94] J/mol×K [708.42; 901.41] Show Hide
Cp,gas 588.79 J/mol×K 708.42 Joback Calculated Property
Cp,gas 601.79 J/mol×K 740.59 Joback Calculated Property
Cp,gas 613.88 J/mol×K 772.75 Joback Calculated Property
Cp,gas 625.10 J/mol×K 804.92 Joback Calculated Property
Cp,gas 635.50 J/mol×K 837.08 Joback Calculated Property
Cp,gas 645.10 J/mol×K 869.25 Joback Calculated Property
Cp,gas 653.94 J/mol×K 901.41 Joback Calculated Property

Similar Compounds

.beta.-Alanine, N-(4-trifluoromethylbenzoyl)-, ethyl ester. .beta.-Alanine, N-(4-trifluoromethylbenzoyl)-, pentyl ester. «beta»-Alanine, N-(3-trifluoromethylbenzoyl)-, propyl ester. .beta.-Alanine, N-(4-trifluoromethylbenzoyl)-, hexyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, dodecyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, tetradecyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, decyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, nonyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, hexadecyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, undecyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, heptyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, octyl ester. «beta»-Alanine, N-(4-trifluoromethylbenzoyl)-, pentadecyl ester. .beta.-Alanine, N-(4-chlorobenzoyl)-, propyl ester. .beta.-Alanine, N-(4-fluorobenzoyl)-, propyl ester.

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

Sources

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