Chemical Properties of D-Alanine, N-(5-chlorovaleryl)-, isohexyl ester

D-Alanine, N-(5-chlorovaleryl)-, isohexyl ester

InChI
InChI=1S/C14H26ClNO3/c1-11(2)7-6-10-19-14(18)12(3)16-13(17)8-4-5-9-15/h11-12H,4-10H2,1-3H3,(H,16,17)
InChI Key
GNZLWQRTBQAPBZ-UHFFFAOYSA-N
Formula
C14H26ClNO3
SMILES
CC(C)CCCOC(=O)C(C)NC(=O)CCCCCl
Molecular Weight1
291.82
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Physical Properties

Property Value Unit Source
ΔfH°gas -838.23 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 40.23 kJ/mol Joback Calculated Property
ΔvapH° 88.30 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 2.880 Crippen Calculated Property
McVol 239.350 ml/mol McGowan Calculated Property
Inp 2103.00 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 [677.02; 755.72] J/mol×K [718.73; 904.51] Show Hide
Cp,gas 677.02 J/mol×K 718.73 Joback Calculated Property
Cp,gas 692.26 J/mol×K 749.69 Joback Calculated Property
Cp,gas 706.63 J/mol×K 780.66 Joback Calculated Property
Cp,gas 720.14 J/mol×K 811.62 Joback Calculated Property
Cp,gas 732.82 J/mol×K 842.58 Joback Calculated Property
Cp,gas 744.67 J/mol×K 873.55 Joback Calculated Property
Cp,gas 755.72 J/mol×K 904.51 Joback Calculated Property

Similar Compounds

D-Alanine, N-(5-chlorovaleryl)-, pentyl ester. D-Alanine, N-(5-chlorovaleryl)-, hexyl ester. D-Alanine, N-(5-chlorovaleryl)-, heptyl ester. D-Alanine, N-(5-chlorovaleryl)-, octyl ester. D-Alanine, N-(5-chlorovaleryl)-, butyl ester. D-Alanine, N-(5-chlorovaleryl)-, isobutyl ester. L-Valine, N-(5-chlorovaleryl)-, isohexyl ester. L-Valine, N-(5-chlorovaleryl)-, pentyl ester. L-Valine, N-(5-chlorovaleryl)-, butyl ester. l-Serine, N,O-bis(5-chlorovaleyl), methyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, pentadecyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, dodecyl ester. l-Serine, N,O-bis(3-cyclopentylpropionyl)-, methyl ester. L-Valine, N-(5-chlorovaleryl)-, isobutyl ester. L-Valine, N-(3-cyclopentylpropionyl)-, butyl ester.

Find more compounds similar to D-Alanine, N-(5-chlorovaleryl)-, isohexyl ester.

Sources

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