Chemical Properties of L-Valine, N-(3-bromobenzoyl)-, octyl ester

L-Valine, N-(3-bromobenzoyl)-, octyl ester

InChI
InChI=1S/C20H30BrNO3/c1-4-5-6-7-8-9-13-25-20(24)18(15(2)3)22-19(23)16-11-10-12-17(21)14-16/h10-12,14-15,18H,4-9,13H2,1-3H3,(H,22,23)
InChI Key
QVDXYLQVRLVOEC-UHFFFAOYSA-N
Formula
C20H30BrNO3
SMILES
CCCCCCCCOC(=O)C(NC(=O)c1cccc(Br)c1)C(C)C
Molecular Weight1
412.37
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Physical Properties

Property Value Unit Source
ΔfusH° 50.51 kJ/mol Joback Calculated Property
log10WS -6.26 Relay (1.0) Calculated Property
logPoct/wat 5.107 Crippen Calculated Property
McVol 305.390 ml/mol McGowan Calculated Property
Pc 1417.57 kPa Joback Calculated Property
Inp [2750.00; 2750.00]   Show Hide
Inp 2750.00 NIST
Inp 2750.00 NIST
Tboil 648.65 K Relay (1.0) Calculated Property
Tfus 344.43 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [942.18; 1011.70] J/mol×K [916.40; 1131.90] Show Hide
Cp,gas 942.18 J/mol×K 916.40 Joback Calculated Property
Cp,gas 956.52 J/mol×K 952.32 Joback Calculated Property
Cp,gas 969.68 J/mol×K 988.23 Joback Calculated Property
Cp,gas 981.72 J/mol×K 1024.15 Joback Calculated Property
Cp,gas 992.70 J/mol×K 1060.06 Joback Calculated Property
Cp,gas 1002.68 J/mol×K 1095.98 Joback Calculated Property
Cp,gas 1011.70 J/mol×K 1131.90 Joback Calculated Property

Similar Compounds

L-Valine, N-(3-bromobenzoyl)-, nonyl ester. L-Valine, N-(3-bromobenzoyl)-, hexyl ester. L-Valine, N-(3-bromobenzoyl)-, heptyl ester. L-Valine, N-(3-bromobenzoyl)-, tetradecyl ester. L-Valine, N-(3-bromobenzoyl)-, pentadecyl ester. L-Valine, N-(3-bromobenzoyl)-, undecyl ester. L-Valine, N-(3-bromobenzoyl)-, dodecyl ester. L-Valine, N-(3-bromobenzoyl)-, decyl ester. L-Valine, N-(3-bromobenzoyl)-, pentyl ester. L-Valine, N-(3-bromobenzoyl)-, butyl ester. L-Valine, N-(3-bromobenzoyl)-, propyl ester. L-Valine, N-(4-fluorobenzoyl)-, decyl ester. L-Valine, N-(4-fluorobenzoyl)-, octadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, heptadecyl ester. L-Valine, N-(4-fluorobenzoyl)-, hexadecyl ester.

Find more compounds similar to L-Valine, N-(3-bromobenzoyl)-, octyl ester.

Sources

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