Chemical Properties of L-Valine, N-(3-bromobenzoyl)-, tetradecyl ester

L-Valine, N-(3-bromobenzoyl)-, tetradecyl ester

InChI
InChI=1S/C26H42BrNO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-19-31-26(30)24(21(2)3)28-25(29)22-17-16-18-23(27)20-22/h16-18,20-21,24H,4-15,19H2,1-3H3,(H,28,29)
InChI Key
NYHQIRUXKFDJTP-UHFFFAOYSA-N
Formula
C26H42BrNO3
SMILES
CCCCCCCCCCCCCCOC(=O)C(NC(=O)c1cccc(Br)c1)C(C)C
Molecular Weight1
496.53
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° 66.05 kJ/mol Joback Calculated Property
log10WS -7.93 Relay (1.0) Calculated Property
logPoct/wat 7.448 Crippen Calculated Property
McVol 389.930 ml/mol McGowan Calculated Property
Pc 957.32 kPa Joback Calculated Property
Inp [3368.00; 3368.00]   Show Hide
Inp 3368.00 NIST
Inp 3368.00 NIST
Tboil 689.79 K Relay (1.0) Calculated Property
Tfus 349.93 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, 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 [1307.12; 1381.85] J/mol×K [1053.68; 1291.29] Show Hide
Cp,gas 1307.12 J/mol×K 1053.68 Joback Calculated Property
Cp,gas 1322.85 J/mol×K 1093.28 Joback Calculated Property
Cp,gas 1337.13 J/mol×K 1132.88 Joback Calculated Property
Cp,gas 1350.07 J/mol×K 1172.49 Joback Calculated Property
Cp,gas 1361.77 J/mol×K 1212.09 Joback Calculated Property
Cp,gas 1372.33 J/mol×K 1251.69 Joback Calculated Property
Cp,gas 1381.85 J/mol×K 1291.29 Joback Calculated Property

Similar Compounds

L-Valine, N-(3-bromobenzoyl)-, octyl ester. L-Valine, N-(3-bromobenzoyl)-, nonyl ester. L-Valine, N-(3-bromobenzoyl)-, hexyl ester. L-Valine, N-(3-bromobenzoyl)-, heptyl ester. L-Valine, N-(3-bromobenzoyl)-, pentadecyl ester. L-Valine, N-(3-bromobenzoyl)-, undecyl ester. L-Valine, N-(3-bromobenzoyl)-, dodecyl ester. L-Valine, N-(3-bromobenzoyl)-, decyl ester. L-Valine, N-(3-bromobenzoyl)-, pentyl ester. L-Valine, N-(3-bromobenzoyl)-, butyl ester. L-Valine, N-(3-bromobenzoyl)-, propyl ester. L-Valine, N-(4-fluorobenzoyl)-, decyl ester. L-Valine, N-(4-fluorobenzoyl)-, octadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, heptadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, hexadecyl ester.

Find more compounds similar to L-Valine, N-(3-bromobenzoyl)-, tetradecyl 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.