Chemical Properties of l-Valine, N-(5-chlrovaleryl)-, methyl ester

l-Valine, N-(5-chlrovaleryl)-, methyl ester

InChI
InChI=1S/C11H20ClNO3/c1-8(2)10(11(15)16-3)13-9(14)6-4-5-7-12/h8,10H,4-7H2,1-3H3,(H,13,14)
InChI Key
ZDCLUYAODLSBMX-UHFFFAOYSA-N
Formula
C11H20ClNO3
SMILES
COC(=O)C(NC(=O)CCCCCl)C(C)C
Molecular Weight1
249.73
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Physical Properties

Property Value Unit Source
ΔfusH° 32.46 kJ/mol Joback Calculated Property
IE 9.18 eV Relay (1.0) Calculated Property
logPoct/wat 1.709 Crippen Calculated Property
McVol 197.080 ml/mol McGowan Calculated Property
Inp [1726.00; 1726.00]   Show Hide
Inp 1726.00 NIST
Inp 1726.00 NIST
Tboil 537.66 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, 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 [516.61; 588.92] J/mol×K [650.09; 839.37] Show Hide
Cp,gas 516.61 J/mol×K 650.09 Joback Calculated Property
Cp,gas 530.55 J/mol×K 681.64 Joback Calculated Property
Cp,gas 543.72 J/mol×K 713.18 Joback Calculated Property
Cp,gas 556.13 J/mol×K 744.73 Joback Calculated Property
Cp,gas 567.79 J/mol×K 776.28 Joback Calculated Property
Cp,gas 578.71 J/mol×K 807.83 Joback Calculated Property
Cp,gas 588.92 J/mol×K 839.37 Joback Calculated Property

Similar Compounds

L-Valine, N-caproyl-, methyl ester. L-valine, n-capryloyl-, methyl ester. L-Valine, N-(5-chlorovaleryl)-, isobutyl ester. l-Valine, N-(3-cyclopentylpropionyl)-, methyl ester. L-Valine, N-(5-chlorovaleryl)-, butyl ester. L-Valine, N-(5-chlorovaleryl)-, pentyl ester. L-Valine, N-(5-chlorovaleryl)-, isohexyl ester. l-Valine, N-butyryl-, methyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, isobutyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, butyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, dodecyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, pentadecyl ester. l-Leucine, N-(5-chlorovaleryl)-, methyl ester. l-Methionine, N-(5-chlorovaleryl)-, methyl ester. (-) Jasmonic acid - (S)-Val conjugate, methyl ester.

Find more compounds similar to l-Valine, N-(5-chlrovaleryl)-, methyl ester.

Sources

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