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

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

InChI
InChI=1S/C17H24BrNO3/c1-4-5-6-10-22-17(21)15(12(2)3)19-16(20)13-8-7-9-14(18)11-13/h7-9,11-12,15H,4-6,10H2,1-3H3,(H,19,20)
InChI Key
LVROHIZESMZYGZ-UHFFFAOYSA-N
Formula
C17H24BrNO3
SMILES
CCCCCOC(=O)C(NC(=O)c1cccc(Br)c1)C(C)C
Molecular Weight1
370.28
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Physical Properties

Property Value Unit Source
ΔfH°gas -592.56 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 42.74 kJ/mol Joback Calculated Property
IE 8.68 eV Relay (1.0) Calculated Property
logPoct/wat 3.937 Crippen Calculated Property
McVol 263.120 ml/mol McGowan Calculated Property
Pc 1783.35 kPa Joback Calculated Property
Inp [2450.00; 2450.00]   Show Hide
Inp 2450.00 NIST
Inp 2450.00 NIST
Tboil 626.38 K Relay (1.0) Calculated Property
Tfus 343.13 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, 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 [767.94; 835.08] J/mol×K [847.76; 1063.98] Show Hide
Cp,gas 767.94 J/mol×K 847.76 Joback Calculated Property
Cp,gas 781.77 J/mol×K 883.80 Joback Calculated Property
Cp,gas 794.47 J/mol×K 919.83 Joback Calculated Property
Cp,gas 806.11 J/mol×K 955.87 Joback Calculated Property
Cp,gas 816.72 J/mol×K 991.90 Joback Calculated Property
Cp,gas 826.37 J/mol×K 1027.94 Joback Calculated Property
Cp,gas 835.08 J/mol×K 1063.98 Joback Calculated Property

Similar Compounds

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

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

Sources

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