Chemical Properties of l-Leucine, N-(5-chlorovaleryl)-, methyl ester

l-Leucine, N-(5-chlorovaleryl)-, methyl ester

InChI
InChI=1S/C12H22ClNO3/c1-9(2)8-10(12(16)17-3)14-11(15)6-4-5-7-13/h9-10H,4-8H2,1-3H3,(H,14,15)
InChI Key
DWVUQKRUDKYQKT-UHFFFAOYSA-N
Formula
C12H22ClNO3
SMILES
COC(=O)C(CC(C)C)NC(=O)CCCCCl
Molecular Weight1
263.76
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
ΔfH°gas -772.41 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 35.05 kJ/mol Joback Calculated Property
ΔvapH° 86.42 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.099 Crippen Calculated Property
McVol 211.170 ml/mol McGowan Calculated Property
Inp [1796.00; 1796.00]   Show Hide
Inp 1796.00 NIST
Inp 1796.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, 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 [568.81; 643.55] J/mol×K [672.97; 860.67] Show Hide
Cp,gas 568.81 J/mol×K 672.97 Joback Calculated Property
Cp,gas 583.24 J/mol×K 704.25 Joback Calculated Property
Cp,gas 596.86 J/mol×K 735.54 Joback Calculated Property
Cp,gas 609.69 J/mol×K 766.82 Joback Calculated Property
Cp,gas 621.73 J/mol×K 798.10 Joback Calculated Property
Cp,gas 633.01 J/mol×K 829.39 Joback Calculated Property
Cp,gas 643.55 J/mol×K 860.67 Joback Calculated Property

Similar Compounds

l-Leucine, N-caproyl-, methyl ester. l-Leucine, N-capryloyl-, methyl ester. Pentanedioic acid, 2-octanoylamino, dimethyl ester. 2-Acetylamino-octanoic acid methyl ester. (-)-Jasmonic acid - (S)-Leu conjugate, methyl ester. l-Valine, N-(5-chlrovaleryl)-, methyl ester. l-Leucine, N-pivaloyl-, methyl ester. Glycyl-L-norleucine, N-dimethylaminomethylene-, methyl ester. l-Methionine, N-(5-chlorovaleryl)-, methyl ester. Gly-Leu, N-dimethylaminomethylene-, methyl ester. L-Alanyl-L-norleucine, N-dimethylaminomethylene-, methyl ester. L-Valine, N-(5-chlorovaleryl)-, isohexyl ester. l-Methionine, N-(3-cyclopentylpropionyl)-, methyl ester. L-Methionine, N-caproyl-, methyl ester. l-Methionine, N-capryloyl-, methyl ester.

Find more compounds similar to l-Leucine, N-(5-chlorovaleryl)-, 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.
These property values are available through the Cheméo API. A free account gives you an access key.