Chemical Properties of DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, dodecyl ester

DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, dodecyl ester

InChI
InChI=1S/C27H53NO4/c1-7-10-12-13-14-15-16-17-18-19-21-31-26(29)25(23(4)5)28(6)27(30)32-22-24(9-3)20-11-8-2/h23-25H,7-22H2,1-6H3
InChI Key
VBJSNIFZNZICRE-UHFFFAOYSA-N
Formula
C27H53NO4
SMILES
CCCCCCCCCCCCOC(=O)C(C(C)C)N(C)C(=O)OCC(CC)CCCC
Molecular Weight1
455.71
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Physical Properties

Property Value Unit Source
ΔfusH° 66.88 kJ/mol Joback Calculated Property
log10WS -6.81 Relay (1.0) Calculated Property
logPoct/wat 7.760 Crippen Calculated Property
McVol 416.150 ml/mol McGowan Calculated Property
Pc 700.61 kPa Joback Calculated Property
Inp [2824.00; 2824.00]   Show Hide
Inp 2824.00 NIST
Inp 2824.00 NIST
Tboil 651.89 K Relay (1.0) Calculated Property
Tfus 262.40 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 [1436.28; 1539.15] J/mol×K [944.92; 1163.20] Show Hide
Cp,gas 1436.28 J/mol×K 944.92 Joback Calculated Property
Cp,gas 1457.80 J/mol×K 981.30 Joback Calculated Property
Cp,gas 1477.49 J/mol×K 1017.68 Joback Calculated Property
Cp,gas 1495.40 J/mol×K 1054.06 Joback Calculated Property
Cp,gas 1511.60 J/mol×K 1090.44 Joback Calculated Property
Cp,gas 1526.16 J/mol×K 1126.82 Joback Calculated Property
Cp,gas 1539.15 J/mol×K 1163.20 Joback Calculated Property

Similar Compounds

DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, tridecyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, octyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, octadecyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, pentadecyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, undecyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, tetradecyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, decyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, heptadecyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, nonyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, hexadecyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, 2-ethylhexyl ester. DL-Valine, N-methyl-N-octyloxycarbonyl-, isobutyl ester. DL-Valine, N-methyl-N-octyloxycarbonyl-, decyl ester. DL-Valine, N-methyl-N-decyloxycarbonyl-, tridecyl ester. DL-Valine, N-methyl-N-octyloxycarbonyl-, heptyl ester.

Find more compounds similar to DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, dodecyl ester.

Sources

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