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

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

InChI
InChI=1S/C26H37F6NO3/c1-4-5-6-7-8-9-10-11-12-13-16-36-24(35)22(18(2)3)33-23(34)20-17-19(25(27,28)29)14-15-21(20)26(30,31)32/h14-15,17-18,22H,4-13,16H2,1-3H3,(H,33,34)
InChI Key
MTWXOSIINWAGKO-UHFFFAOYSA-N
Formula
C26H37F6NO3
SMILES
CCCCCCCCCCCCOC(=O)C(NC(=O)c1cc(C(F)(F)F)ccc1C(F)(F)F)C(C)C
Molecular Weight1
525.57
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° 64.03 kJ/mol Joback Calculated Property
logPoct/wat 7.943 Crippen Calculated Property
McVol 383.050 ml/mol McGowan Calculated Property
Inp [2634.00; 2634.00]   Show Hide
Inp 2634.00 NIST
Inp 2634.00 NIST
Tboil 659.93 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [1308.22; 1391.45] J/mol×K [981.66; 1207.81] Show Hide
Cp,gas 1308.22 J/mol×K 981.66 Joback Calculated Property
Cp,gas 1324.97 J/mol×K 1019.35 Joback Calculated Property
Cp,gas 1340.40 J/mol×K 1057.04 Joback Calculated Property
Cp,gas 1354.63 J/mol×K 1094.73 Joback Calculated Property
Cp,gas 1367.80 J/mol×K 1132.43 Joback Calculated Property
Cp,gas 1380.03 J/mol×K 1170.12 Joback Calculated Property
Cp,gas 1391.45 J/mol×K 1207.81 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to L-Valine, N-(2,5-ditrifluoromethylbenzoyl)-, dodecyl 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.