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

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

InChI
InChI=1S/C21H32BrNO3/c1-4-5-6-7-8-9-10-14-26-21(25)19(16(2)3)23-20(24)17-12-11-13-18(22)15-17/h11-13,15-16,19H,4-10,14H2,1-3H3,(H,23,24)
InChI Key
DHWILQRKPJMRJN-UHFFFAOYSA-N
Formula
C21H32BrNO3
SMILES
CCCCCCCCCOC(=O)C(NC(=O)c1cccc(Br)c1)C(C)C
Molecular Weight1
426.39
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Physical Properties

Property Value Unit Source
ΔfusH° 53.10 kJ/mol Joback Calculated Property
log10WS -6.54 Relay (1.0) Calculated Property
logPoct/wat 5.497 Crippen Calculated Property
McVol 319.480 ml/mol McGowan Calculated Property
Pc 1320.39 kPa Joback Calculated Property
Inp [2847.00; 2847.00]   Show Hide
Inp 2847.00 NIST
Inp 2847.00 NIST
Tboil 655.58 K Relay (1.0) Calculated Property
Tfus 345.31 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 [1001.64; 1071.88] J/mol×K [939.28; 1156.09] Show Hide
Cp,gas 1001.64 J/mol×K 939.28 Joback Calculated Property
Cp,gas 1016.16 J/mol×K 975.41 Joback Calculated Property
Cp,gas 1029.46 J/mol×K 1011.55 Joback Calculated Property
Cp,gas 1041.63 J/mol×K 1047.68 Joback Calculated Property
Cp,gas 1052.71 J/mol×K 1083.82 Joback Calculated Property
Cp,gas 1062.77 J/mol×K 1119.95 Joback Calculated Property
Cp,gas 1071.88 J/mol×K 1156.09 Joback Calculated Property

Similar Compounds

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

Sources

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