Chemical Properties of 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)-, pentyl ester

InChI
InChI=1S/C22H38N2O5/c1-9-11-13-15-28-21(26)19(17(5)6)23(7)20(25)18(16(3)4)24(8)22(27)29-14-12-10-2/h2,16-19H,9,11-15H2,1,3-8H3
InChI Key
LDKKTOFVKNJUBI-UHFFFAOYSA-N
Formula
C22H38N2O5
SMILES
C#CCCOC(=O)N(C)C(C(=O)N(C)C(C(=O)OCCCCC)C(C)C)C(C)C
Molecular Weight1
410.55
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Physical Properties

Property Value Unit Source
ΔfusH° 54.83 kJ/mol Joback Calculated Property
logPoct/wat 3.319 Crippen Calculated Property
McVol 348.650 ml/mol McGowan Calculated Property
Inp [2420.00; 2420.00]   Show Hide
Inp 2420.00 NIST
Inp 2420.00 NIST
Tboil 639.93 K Relay (1.0) Calculated Property
Tfus 333.00 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, Log10 of Water solubility in mol/l 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 [1143.27; 1225.05] J/mol×K [922.45; 1129.82] Show Hide
Cp,gas 1143.27 J/mol×K 922.45 Joback Calculated Property
Cp,gas 1159.96 J/mol×K 957.01 Joback Calculated Property
Cp,gas 1175.35 J/mol×K 991.57 Joback Calculated Property
Cp,gas 1189.51 J/mol×K 1026.14 Joback Calculated Property
Cp,gas 1202.48 J/mol×K 1060.70 Joback Calculated Property
Cp,gas 1214.31 J/mol×K 1095.26 Joback Calculated Property
Cp,gas 1225.05 J/mol×K 1129.82 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(but-3-yn-1-yloxycarbonyl)-, pentyl ester.

Sources

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