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

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

InChI
InChI=1S/C18H26BrNO3/c1-4-5-6-7-11-23-18(22)16(13(2)3)20-17(21)14-9-8-10-15(19)12-14/h8-10,12-13,16H,4-7,11H2,1-3H3,(H,20,21)
InChI Key
LOXGCZNKWIALOH-UHFFFAOYSA-N
Formula
C18H26BrNO3
SMILES
CCCCCCOC(=O)C(NC(=O)c1cccc(Br)c1)C(C)C
Molecular Weight1
384.31
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Physical Properties

Property Value Unit Source
ΔfusH° 45.33 kJ/mol Joback Calculated Property
log10WS -5.63 Relay (1.0) Calculated Property
logPoct/wat 4.327 Crippen Calculated Property
McVol 277.210 ml/mol McGowan Calculated Property
Pc 1647.09 kPa Joback Calculated Property
Inp [2548.00; 2548.00]   Show Hide
Inp 2548.00 NIST
Inp 2548.00 NIST
Tboil 634.22 K Relay (1.0) Calculated Property
Tfus 342.21 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 [825.27; 893.29] J/mol×K [870.64; 1085.89] Show Hide
Cp,gas 825.27 J/mol×K 870.64 Joback Calculated Property
Cp,gas 839.27 J/mol×K 906.52 Joback Calculated Property
Cp,gas 852.14 J/mol×K 942.39 Joback Calculated Property
Cp,gas 863.93 J/mol×K 978.27 Joback Calculated Property
Cp,gas 874.68 J/mol×K 1014.14 Joback Calculated Property
Cp,gas 884.45 J/mol×K 1050.02 Joback Calculated Property
Cp,gas 893.29 J/mol×K 1085.89 Joback Calculated Property

Similar Compounds

L-Valine, N-(3-bromobenzoyl)-, octyl ester. L-Valine, N-(3-bromobenzoyl)-, nonyl 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)-, hexyl ester.

Sources

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