Chemical Properties of l-Valine, N-(4-butylbenzoyl)-, methyl ester

l-Valine, N-(4-butylbenzoyl)-, methyl ester

InChI
InChI=1S/C17H25NO3/c1-5-6-7-13-8-10-14(11-9-13)16(19)18-15(12(2)3)17(20)21-4/h8-12,15H,5-7H2,1-4H3,(H,18,19)
InChI Key
RBRGEJUNVSRVJT-UHFFFAOYSA-N
Formula
C17H25NO3
SMILES
CCCCc1ccc(C(=O)NC(C(=O)OC)C(C)C)cc1
Molecular Weight1
291.39
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Physical Properties

Property Value Unit Source
ΔfusH° 35.88 kJ/mol Joback Calculated Property
IE 8.58 eV Relay (1.0) Calculated Property
logPoct/wat 2.957 Crippen Calculated Property
McVol 245.620 ml/mol McGowan Calculated Property
Inp [2191.00; 2191.00]   Show Hide
Inp 2191.00 NIST
Inp 2191.00 NIST
Tboil 606.37 K Relay (1.0) Calculated Property
Tfus 362.23 K Relay (1.0) Calculated Property

Cheméo can also estimate 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 [734.43; 811.50] J/mol×K [799.47; 1007.62] Show Hide
Cp,gas 734.43 J/mol×K 799.47 Joback Calculated Property
Cp,gas 749.88 J/mol×K 834.16 Joback Calculated Property
Cp,gas 764.24 J/mol×K 868.85 Joback Calculated Property
Cp,gas 777.56 J/mol×K 903.54 Joback Calculated Property
Cp,gas 789.85 J/mol×K 938.23 Joback Calculated Property
Cp,gas 801.16 J/mol×K 972.92 Joback Calculated Property
Cp,gas 811.50 J/mol×K 1007.62 Joback Calculated Property

Similar Compounds

L-Valine, N-(4-ethylbenzoyl)-, propyl ester. L-Valine, N-(4-ethylbenzoyl)-, pentyl ester. L-Valine, N-(4-ethylbenzoyl)-, heptyl ester. L-Valine, N-(4-ethylbenzoyl)-, undecyl ester. L-Valine, N-(4-ethylbenzoyl)-, dodecyl ester. L-Valine, N-(4-ethylbenzoyl)-, pentadecyl ester. L-Valine, N-(4-ethylbenzoyl)-, decyl ester. L-Valine, N-(4-ethylbenzoyl)-, nonyl ester. L-Valine, N-(4-ethylbenzoyl)-, tetradecyl ester. l-Methionine, N-(4-butylbenzoyl)-, methyl ester. l-Valine, N-(p-toluoyl)-, methyl ester. L-Valine, N-(4-methylbenzoyl)-, butyl ester. L-Proline, N-(4-butylbenzoyl)-, octyl ester. L-Proline, N-(4-butylbenzoyl)-, undecyl ester. L-Proline, N-(4-butylbenzoyl)-, decyl ester.

Find more compounds similar to l-Valine, N-(4-butylbenzoyl)-, methyl ester.

Sources

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