please re-login

Chemical Properties of L-Alanine, N-(2-trifluoromethylbenzoyl)-, methyl ester

L-Alanine, N-(2-trifluoromethylbenzoyl)-, methyl ester

InChI
InChI=1S/C12H12F3NO3/c1-7(11(18)19-2)16-10(17)8-5-3-4-6-9(8)12(13,14)15/h3-7H,1-2H3,(H,16,17)
InChI Key
HOYZGOAJCOOKFM-UHFFFAOYSA-N
Formula
C12H12F3NO3
SMILES
COC(=O)C(C)NC(=O)c1ccccc1C(F)(F)F
Molecular Weight1
275.23
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 28.28 kJ/mol Joback Calculated Property
log10WS -2.77 Relay (1.0) Calculated Property
logPoct/wat 1.997 Crippen Calculated Property
McVol 180.480 ml/mol McGowan Calculated Property
Inp 1597.00 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 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 [489.51; 550.01] J/mol×K [680.09; 882.17] Show Hide
Cp,gas 489.51 J/mol×K 680.09 Joback Calculated Property
Cp,gas 501.62 J/mol×K 713.77 Joback Calculated Property
Cp,gas 512.87 J/mol×K 747.45 Joback Calculated Property
Cp,gas 523.30 J/mol×K 781.13 Joback Calculated Property
Cp,gas 532.95 J/mol×K 814.81 Joback Calculated Property
Cp,gas 541.84 J/mol×K 848.49 Joback Calculated Property
Cp,gas 550.01 J/mol×K 882.17 Joback Calculated Property

Similar Compounds

D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, ethyl ester. l-Alanine, N-(3-trifluoromethylbenzoyl)-, methyl ester. D-Alanine, N-(4-fluoro-2-trifluoromethylbenzoyl)-, ethyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, propyl ester. D-Alanine, N-(4-fluoro-2-trifluoromethylbenzoyl)-, propyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, pentyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, butyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, decyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, hexyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, heptyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, hexadecyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, nonyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, octyl ester. D-Alanine, N-(2,5-ditrifluoromethylbenzoyl)-, octadecyl ester. D-Alanine, N-(4-fluoro-2-trifluoromethylbenzoyl)-, butyl ester.

Find more compounds similar to L-Alanine, N-(2-trifluoromethylbenzoyl)-, methyl ester.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.