Chemical Properties of L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, ethyl ester

L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, ethyl ester

InChI
InChI=1S/C16H17F6NO3/c1-4-26-14(25)12(8(2)3)23-13(24)10-7-9(15(17,18)19)5-6-11(10)16(20,21)22/h5-8,12H,4H2,1-3H3,(H,23,24)
InChI Key
DHAMIGHWGJCHQG-UHFFFAOYSA-N
Formula
C16H17F6NO3
SMILES
CCOC(=O)C(NC(=O)c1cc(C(F)(F)F)ccc1C(F)(F)F)C(C)C
Molecular Weight1
385.30
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° 38.13 kJ/mol Joback Calculated Property
logPoct/wat 4.042 Crippen Calculated Property
McVol 242.150 ml/mol McGowan Calculated Property
Inp [1719.00; 1719.00]   Show Hide
Inp 1719.00 NIST
Inp 1719.00 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 [722.34; 785.90] J/mol×K [752.86; 939.80] Show Hide
Cp,gas 722.34 J/mol×K 752.86 Joback Calculated Property
Cp,gas 735.09 J/mol×K 784.02 Joback Calculated Property
Cp,gas 746.91 J/mol×K 815.17 Joback Calculated Property
Cp,gas 757.85 J/mol×K 846.33 Joback Calculated Property
Cp,gas 767.96 J/mol×K 877.49 Joback Calculated Property
Cp,gas 777.30 J/mol×K 908.65 Joback Calculated Property
Cp,gas 785.90 J/mol×K 939.80 Joback Calculated Property

Similar Compounds

L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, propyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, butyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, pentyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, ethyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, undecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, decyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, heptyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, heptadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, octadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, octyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, tetradecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, dodecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, hexadecyl ester. L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, pentadecyl ester.

Find more compounds similar to L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, ethyl 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.
These property values are available through the Cheméo API. A free account gives you an access key.