Chemical Properties of Isonipecotic acid, N-(3-cyclopentylpropionyl)-, tridecyl ester

Isonipecotic acid, N-(3-cyclopentylpropionyl)-, tridecyl ester

InChI
InChI=1S/C27H49NO3/c1-2-3-4-5-6-7-8-9-10-11-14-23-31-27(30)25-19-21-28(22-20-25)26(29)18-17-24-15-12-13-16-24/h24-25H,2-23H2,1H3
InChI Key
QQUOTIOEANKACW-UHFFFAOYSA-N
Formula
C27H49NO3
SMILES
CCCCCCCCCCCCCOC(=O)C1CCN(C(=O)CCC2CCCC2)CC1
Molecular Weight1
435.69
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Physical Properties

Property Value Unit Source
logPoct/wat 7.050 Crippen Calculated Property
McVol 388.560 ml/mol McGowan Calculated Property
Inp [3539.00; 3539.00]   Show Hide
Inp 3539.00 NIST
Inp 3539.00 NIST
Tfus 322.11 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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.

Similar Compounds

Isonipecotic acid, N-(3-cyclopentylpropionyl)-, pentyl ester. Isonipecotic acid, N-(3-cyclopentylpropionyl)-, octyl ester. Isonipecotic acid, N-(3-cyclopentylpropionyl)-, heptyl ester. Isonipecotic acid, N-(3-cyclopentylpropionyl)-, hexyl ester. Isonipecotic acid, N-(3-cyclopentylpropionyl)-, undecyl ester. Isonipecotic acid, N-(3-cyclopentylpropionyl)-, decyl ester. Isonipecotic acid, N-(3-cyclopentylpropionyl)-, dodecyl ester. Isonipecotic acid, N-(3-cyclopentylpropionyl)-, nonyl ester. Isonipecotic acid, N-(3-cyclopentylpropionyl)-, isohexyl ester. Isonipecotic acid, N-(octanoyl)-, isohexyl ester. Isonipecotic acid, N-(octanoyl)-, octyl ester. Isonipecotic acid, N-(octanoyl)-, nonyl ester. Isonipecotic acid, N-(octanoyl)-, heptyl ester. Isonipecotic acid, N-(octanoyl)-, undecyl ester. Isonipecotic acid, N-(octanoyl)-, decyl ester.

Find more compounds similar to Isonipecotic acid, N-(3-cyclopentylpropionyl)-, tridecyl ester.

Sources

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