Chemical Properties of DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, tridecyl ester

DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, tridecyl ester

InChI
InChI=1S/C24H45NO4/c1-6-8-10-11-12-13-14-15-16-17-18-20-28-23(26)22(21(3)4)25(5)24(27)29-19-9-7-2/h7,21-22H,2,6,8-20H2,1,3-5H3
InChI Key
POINDAUGJXAJJM-UHFFFAOYSA-N
Formula
C24H45NO4
SMILES
C=CCCOC(=O)N(C)C(C(=O)OCCCCCCCCCCCCC)C(C)C
Molecular Weight1
411.62
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Physical Properties

Property Value Unit Source
ΔfusH° 61.35 kJ/mol Joback Calculated Property
log10WS -5.75 Relay (1.0) Calculated Property
logPoct/wat 6.510 Crippen Calculated Property
McVol 369.580 ml/mol McGowan Calculated Property
Inp [2663.00; 2663.00]   Show Hide
Inp 2663.00 NIST
Inp 2663.00 NIST
Tboil 653.61 K Relay (1.0) Calculated Property
Tfus 279.68 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, 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 [552.36; 1284.32] 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 A1.48440e+01
Coefficient B2.28998e+00
Coefficient C-1.23450e-03
Coefficient D2.14000e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 552.36 J/mol×K 273.00 Calculated Property
Cp,gas 679.96 J/mol×K 353.78 Calculated Property
Cp,gas 794.41 J/mol×K 434.56 Calculated Property
Cp,gas 896.39 J/mol×K 515.33 Calculated Property
Cp,gas 986.58 J/mol×K 596.11 Calculated Property
Cp,gas 1065.65 J/mol×K 676.89 Calculated Property
Cp,gas 1134.29 J/mol×K 757.67 Calculated Property
Cp,gas 1193.16 J/mol×K 838.44 Calculated Property
Cp,gas 1242.95 J/mol×K 919.22 Calculated Property
Cp,gas 1284.32 J/mol×K 1000.00 Calculated Property

Similar Compounds

DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, dodecyl ester. DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, undecyl ester. DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, heptadecyl ester. DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, nonyl ester. DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, tetradecyl ester. DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, pentadecyl ester. DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, octadecyl ester. DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, decyl ester. DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, hexadecyl ester. DL-Valine, N-methyl-N-octyloxycarbonyl-, pentyl ester. DL-Valine, N-methyl-N-hexyloxycarbonyl-, dodecyl ester. DL-Valine, N-methyl-N-decyloxycarbonyl-, hexadecyl ester. DL-Valine, N-methyl-N-hexyloxycarbonyl-, undecyl ester. DL-Valine, N-methyl-N-hexyloxycarbonyl-, butyl ester. DL-Valine, N-methyl-N-octyloxycarbonyl-, heptyl ester.

Find more compounds similar to DL-Valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, tridecyl ester.

Sources

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