Chemical Properties of 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)-, heptyl ester

InChI
InChI=1S/C24H42N2O5/c1-9-11-13-14-15-17-30-23(28)21(19(5)6)25(7)22(27)20(18(3)4)26(8)24(29)31-16-12-10-2/h2,18-21H,9,11-17H2,1,3-8H3
InChI Key
PLSTYUFEDIDQAL-UHFFFAOYSA-N
Formula
C24H42N2O5
SMILES
C#CCCOC(=O)N(C)C(C(=O)N(C)C(C(=O)OCCCCCCC)C(C)C)C(C)C
Molecular Weight1
438.60
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Physical Properties

Property Value Unit Source
ΔfusH° 60.01 kJ/mol Joback Calculated Property
log10WS -4.32 Relay (1.0) Calculated Property
logPoct/wat 4.099 Crippen Calculated Property
McVol 376.830 ml/mol McGowan Calculated Property
Inp [2614.00; 2614.00]   Show Hide
Inp 2614.00 NIST
Inp 2614.00 NIST
Tboil 655.96 K Relay (1.0) Calculated Property
Tfus 333.98 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 [1266.83; 1350.48] J/mol×K [968.21; 1185.89] Show Hide
Cp,gas 1266.83 J/mol×K 968.21 Joback Calculated Property
Cp,gas 1284.16 J/mol×K 1004.49 Joback Calculated Property
Cp,gas 1300.05 J/mol×K 1040.77 Joback Calculated Property
Cp,gas 1314.56 J/mol×K 1077.05 Joback Calculated Property
Cp,gas 1327.76 J/mol×K 1113.33 Joback Calculated Property
Cp,gas 1339.71 J/mol×K 1149.61 Joback Calculated Property
Cp,gas 1350.48 J/mol×K 1185.89 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)-, pentyl ester. DL-Valyl-DL-Valine, N,N'-dimethyl-N'-(but-3-yn-1-yloxycarbonyl)-, nonyl 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)-, heptyl ester.

Sources

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