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

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

InChI
InChI=1S/C24H47NO4/c1-7-10-12-13-14-15-16-18-28-23(26)22(20(4)5)25(6)24(27)29-19-21(9-3)17-11-8-2/h20-22H,7-19H2,1-6H3
InChI Key
BSTINVQYGDUEHP-UHFFFAOYSA-N
Formula
C24H47NO4
SMILES
CCCCCCCCCOC(=O)C(C(C)C)N(C)C(=O)OCC(CC)CCCC
Molecular Weight1
413.63
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Physical Properties

Property Value Unit Source
ΔfusH° 59.11 kJ/mol Joback Calculated Property
log10WS -5.86 Relay (1.0) Calculated Property
logPoct/wat 6.590 Crippen Calculated Property
McVol 373.880 ml/mol McGowan Calculated Property
Pc 821.01 kPa Joback Calculated Property
Inp [2523.00; 2523.00]   Show Hide
Inp 2523.00 NIST
Inp 2523.00 NIST
Tboil 631.32 K Relay (1.0) Calculated Property
Tfus 250.42 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 [561.85; 1313.37] 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 A1.61530e+01
Coefficient B2.31592e+00
Coefficient C-1.21480e-03
Coefficient D1.96100e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 561.85 J/mol×K 273.00 Calculated Property
Cp,gas 692.11 J/mol×K 353.78 Calculated Property
Cp,gas 809.24 J/mol×K 434.56 Calculated Property
Cp,gas 913.85 J/mol×K 515.33 Calculated Property
Cp,gas 1006.56 J/mol×K 596.11 Calculated Property
Cp,gas 1088.00 J/mol×K 676.89 Calculated Property
Cp,gas 1158.77 J/mol×K 757.67 Calculated Property
Cp,gas 1219.52 J/mol×K 838.44 Calculated Property
Cp,gas 1270.84 J/mol×K 919.22 Calculated Property
Cp,gas 1313.37 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)-, heptadecyl ester. DL-Valine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, dodecyl 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)-, nonyl ester.

Sources

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