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

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

InChI
InChI=1S/C13H14F3NO3/c1-2-20-11(18)7-8-17-12(19)9-3-5-10(6-4-9)13(14,15)16/h3-6H,2,7-8H2,1H3,(H,17,19)
InChI Key
BELQGTLEMRHCFH-UHFFFAOYSA-N
Formula
C13H14F3NO3
SMILES
CCOC(=O)CCNC(=O)c1ccc(C(F)(F)F)cc1
Molecular Weight1
289.25
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Physical Properties

Property Value Unit Source
ΔfusH° 35.97 kJ/mol Joback Calculated Property
logPoct/wat 2.388 Crippen Calculated Property
McVol 194.570 ml/mol McGowan Calculated Property
Inp [1823.00; 1823.00]   Show Hide
Inp 1823.00 NIST
Inp 1823.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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 [536.48; 599.50] J/mol×K [685.54; 880.14] Show Hide
Cp,gas 536.48 J/mol×K 685.54 Joback Calculated Property
Cp,gas 549.08 J/mol×K 717.97 Joback Calculated Property
Cp,gas 560.80 J/mol×K 750.41 Joback Calculated Property
Cp,gas 571.66 J/mol×K 782.84 Joback Calculated Property
Cp,gas 581.71 J/mol×K 815.27 Joback Calculated Property
Cp,gas 590.97 J/mol×K 847.71 Joback Calculated Property
Cp,gas 599.50 J/mol×K 880.14 Joback Calculated Property

Similar Compounds

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

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

Sources

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