Chemical Properties of L-Valine, N-(4-methylbenzoyl)-, isohexyl ester

L-Valine, N-(4-methylbenzoyl)-, isohexyl ester

InChI
InChI=1S/C19H29NO3/c1-13(2)7-6-12-23-19(22)17(14(3)4)20-18(21)16-10-8-15(5)9-11-16/h8-11,13-14,17H,6-7,12H2,1-5H3,(H,20,21)
InChI Key
MNPSLAIKQFGFJW-UHFFFAOYSA-N
Formula
C19H29NO3
SMILES
Cc1ccc(C(=O)NC(C(=O)OCCCC(C)C)C(C)C)cc1
Molecular Weight1
319.44
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Physical Properties

Property Value Unit Source
ΔfusH° 39.12 kJ/mol Joback Calculated Property
logPoct/wat 3.729 Crippen Calculated Property
McVol 273.800 ml/mol McGowan Calculated Property
Inp [2351.00; 2351.00]   Show Hide
Inp 2351.00 NIST
Inp 2351.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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 [844.30; 923.81] J/mol×K [826.92; 1033.47] Show Hide
Cp,gas 844.30 J/mol×K 826.92 Joback Calculated Property
Cp,gas 860.44 J/mol×K 861.34 Joback Calculated Property
Cp,gas 875.38 J/mol×K 895.77 Joback Calculated Property
Cp,gas 889.14 J/mol×K 930.19 Joback Calculated Property
Cp,gas 901.78 J/mol×K 964.62 Joback Calculated Property
Cp,gas 913.32 J/mol×K 999.04 Joback Calculated Property
Cp,gas 923.81 J/mol×K 1033.47 Joback Calculated Property

Similar Compounds

L-Valine, N-(4-methylbenzoyl)-, pentyl ester. L-Valine, N-(4-methylbenzoyl)-, tetradecyl ester. L-Valine, N-(4-methylbenzoyl)-, hexadecyl ester. L-Valine, N-(4-methylbenzoyl)-, dodecyl ester. L-Valine, N-(4-methylbenzoyl)-, undecyl ester. L-Valine, N-(4-methylbenzoyl)-, pentadecyl ester. L-Valine, N-(4-methylbenzoyl)-, heptadecyl ester. L-Valine, N-(4-methylbenzoyl)-, hexyl ester. L-Valine, N-(4-methylbenzoyl)-, butyl ester. L-Valine, N-(4-methylbenzoyl)-, propyl ester. L-Valine, N-(4-ethylbenzoyl)-, pentyl ester. L-Valine, N-(3-methylbenzoyl)-, dodecyl ester. L-Valine, N-(3-methylbenzoyl)-, undecyl ester. L-Valine, N-(4-methylbenzoyl)-, isobutyl ester. L-Valine, N-(3-trifluoromethylbenzoyl)-, isohexyl ester.

Find more compounds similar to L-Valine, N-(4-methylbenzoyl)-, isohexyl ester.

Sources

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