Chemical Properties of DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, octyl ester

DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, octyl ester

InChI
InChI=1S/C24H45ClN2O5/c1-8-9-10-11-12-13-16-31-23(29)21(19(4)5)26(6)22(28)20(18(2)3)27(7)24(30)32-17-14-15-25/h18-21H,8-17H2,1-7H3
InChI Key
KYVQFZZZSWLSHF-UHFFFAOYSA-N
Formula
C24H45ClN2O5
SMILES
CCCCCCCCOC(=O)C(C(C)C)N(C)C(=O)C(C(C)C)N(C)C(=O)OCCCCl
Molecular Weight1
477.08
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Physical Properties

Property Value Unit Source
ΔfusH° 61.24 kJ/mol Joback Calculated Property
log10WS -4.80 Relay (1.0) Calculated Property
logPoct/wat 5.095 Crippen Calculated Property
McVol 397.670 ml/mol McGowan Calculated Property
Inp [2878.00; 2878.00]   Show Hide
Inp 2878.00 NIST
Inp 2878.00 NIST
Tboil 644.68 K Relay (1.0) Calculated Property
Tfus 314.93 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1355.45; 1435.09] J/mol×K [1015.52; 1249.29] Show Hide
Cp,gas 1355.45 J/mol×K 1015.52 Joback Calculated Property
Cp,gas 1372.77 J/mol×K 1054.48 Joback Calculated Property
Cp,gas 1388.37 J/mol×K 1093.44 Joback Calculated Property
Cp,gas 1402.32 J/mol×K 1132.41 Joback Calculated Property
Cp,gas 1414.71 J/mol×K 1171.37 Joback Calculated Property
Cp,gas 1425.60 J/mol×K 1210.33 Joback Calculated Property
Cp,gas 1435.09 J/mol×K 1249.29 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(3-chloropropoxycarbonyl)-, octyl ester.

Sources

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