Chemical Properties of DL-Valyl-DL-Valine, N,N'-dimethyl-N'-vinyloxycarbonyl-, octyl ester

DL-Valyl-DL-Valine, N,N'-dimethyl-N'-vinyloxycarbonyl-, octyl ester

InChI
InChI=1S/C23H42N2O5/c1-9-11-12-13-14-15-16-30-22(27)20(18(5)6)24(7)21(26)19(17(3)4)25(8)23(28)29-10-2/h10,17-20H,2,9,11-16H2,1,3-8H3
InChI Key
AZSKSRRPAYNWDJ-UHFFFAOYSA-N
Formula
C23H42N2O5
SMILES
C=COC(=O)N(C)C(C(=O)N(C)C(C(=O)OCCCCCCCC)C(C)C)C(C)C
Molecular Weight1
426.60
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Physical Properties

Property Value Unit Source
ΔfusH° 56.33 kJ/mol Joback Calculated Property
log10WS -4.31 Relay (1.0) Calculated Property
logPoct/wat 4.610 Crippen Calculated Property
McVol 367.040 ml/mol McGowan Calculated Property
Inp [2507.00; 2507.00]   Show Hide
Inp 2507.00 NIST
Inp 2507.00 NIST
Tboil 630.14 K Relay (1.0) Calculated Property
Tfus 302.53 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 [546.95; 1260.86] 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 A9.05700e+00
Coefficient B2.30274e+00
Coefficient C-1.28040e-03
Coefficient D2.29460e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 546.95 J/mol×K 273.00 Calculated Property
Cp,gas 673.62 J/mol×K 353.78 Calculated Property
Cp,gas 786.77 J/mol×K 434.56 Calculated Property
Cp,gas 887.10 J/mol×K 515.33 Calculated Property
Cp,gas 975.36 J/mol×K 596.11 Calculated Property
Cp,gas 1052.27 J/mol×K 676.89 Calculated Property
Cp,gas 1118.54 J/mol×K 757.67 Calculated Property
Cp,gas 1174.92 J/mol×K 838.44 Calculated Property
Cp,gas 1222.11 J/mol×K 919.22 Calculated Property
Cp,gas 1260.86 J/mol×K 1000.00 Calculated Property

Similar Compounds

DL-Valyl-DL-Valine, N,N'-dimethyl-N'-vinyloxycarbonyl-, pentyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-vinyloxycarbonyl-, hexyl ester. DL-Valyl-DL-valine, N-methyl-N-hexyloxycarbonyl-, hexyl ester. DL-Valyl-DL-valine, N-methyl-N-octyloxycarbonyl-, octyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, pentyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(but-3-yn-1-yloxycarbonyl)-, pentyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(but-3-yn-1-yloxycarbonyl)-, hexyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, octyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(but-3-yn-1-yloxycarbonyl)-, nonyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(but-3-yn-1-yloxycarbonyl)-, heptyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(but-3-yn-1-yloxycarbonyl)-, octyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(but-3-yn-1-yloxycarbonyl)-, butyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, butyl ester. DL-Valyl-DL-valine, N-methyl-N-(but-3-en-1-yloxycarbonyl)-, but-3-en-1-yl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, 3-chloropropyl ester.

Find more compounds similar to DL-Valyl-DL-Valine, N,N'-dimethyl-N'-vinyloxycarbonyl-, octyl ester.

Sources

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