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

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

InChI
InChI=1S/C25H49NO4/c1-7-10-12-13-14-15-16-17-19-29-24(27)23(21(4)5)26(6)25(28)30-20-22(9-3)18-11-8-2/h21-23H,7-20H2,1-6H3
InChI Key
QYSJHHSLJUGIEJ-UHFFFAOYSA-N
Formula
C25H49NO4
SMILES
CCCCCCCCCCOC(=O)C(C(C)C)N(C)C(=O)OCC(CC)CCCC
Molecular Weight1
427.66
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Physical Properties

Property Value Unit Source
ΔfusH° 61.70 kJ/mol Joback Calculated Property
log10WS -6.17 Relay (1.0) Calculated Property
logPoct/wat 6.980 Crippen Calculated Property
McVol 387.970 ml/mol McGowan Calculated Property
Pc 777.64 kPa Joback Calculated Property
Inp [2623.00; 2623.00]   Show Hide
Inp 2623.00 NIST
Inp 2623.00 NIST
Tboil 638.19 K Relay (1.0) Calculated Property
Tfus 254.53 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 [583.07; 1364.96] 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 A1.52440e+01
Coefficient B2.41092e+00
Coefficient C-1.26920e-03
Coefficient D2.08000e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 583.07 J/mol×K 273.00 Calculated Property
Cp,gas 718.53 J/mol×K 353.78 Calculated Property
Cp,gas 840.32 J/mol×K 434.56 Calculated Property
Cp,gas 949.08 J/mol×K 515.33 Calculated Property
Cp,gas 1045.47 J/mol×K 596.11 Calculated Property
Cp,gas 1130.16 J/mol×K 676.89 Calculated Property
Cp,gas 1203.79 J/mol×K 757.67 Calculated Property
Cp,gas 1267.03 J/mol×K 838.44 Calculated Property
Cp,gas 1320.54 J/mol×K 919.22 Calculated Property
Cp,gas 1364.96 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)-, heptadecyl 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)-, decyl ester.

Sources

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