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

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

InChI
InChI=1S/C32H63NO4/c1-7-10-12-13-14-15-16-17-18-19-20-21-22-23-24-26-36-31(34)30(28(4)5)33(6)32(35)37-27-29(9-3)25-11-8-2/h28-30H,7-27H2,1-6H3
InChI Key
GWGXOWNBIKSINP-UHFFFAOYSA-N
Formula
C32H63NO4
SMILES
CCCCCCCCCCCCCCCCCOC(=O)C(C(C)C)N(C)C(=O)OCC(CC)CCCC
Molecular Weight1
525.85
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Physical Properties

Property Value Unit Source
ΔfusH° 79.83 kJ/mol Joback Calculated Property
log10WS -8.36 Relay (1.0) Calculated Property
logPoct/wat 9.710 Crippen Calculated Property
McVol 486.600 ml/mol McGowan Calculated Property
Pc 551.55 kPa Joback Calculated Property
Inp [3332.00; 3332.00]   Show Hide
Inp 3332.00 NIST
Inp 3332.00 NIST
Tboil 685.17 K Relay (1.0) Calculated Property
Tfus 277.97 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [731.56; 1726.10] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A8.88100e+00
Coefficient B3.07592e+00
Coefficient C-1.65000e-03
Coefficient D2.91300e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 731.56 J/mol×K 273.00 Calculated Property
Cp,gas 903.46 J/mol×K 353.78 Calculated Property
Cp,gas 1057.86 J/mol×K 434.56 Calculated Property
Cp,gas 1195.68 J/mol×K 515.33 Calculated Property
Cp,gas 1317.85 J/mol×K 596.11 Calculated Property
Cp,gas 1425.29 J/mol×K 676.89 Calculated Property
Cp,gas 1518.91 J/mol×K 757.67 Calculated Property
Cp,gas 1599.63 J/mol×K 838.44 Calculated Property
Cp,gas 1668.39 J/mol×K 919.22 Calculated Property
Cp,gas 1726.10 J/mol×K 1000.00 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)-, dodecyl 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)-, heptadecyl ester.

Sources

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