Chemical Properties of Isonipecotic acid, N-(4-butylbenzoyl)-, isohexyl ester

Isonipecotic acid, N-(4-butylbenzoyl)-, isohexyl ester

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InChI
InChI=1S/C23H35NO3/c1-4-5-8-19-9-11-20(12-10-19)22(25)24-15-13-21(14-16-24)23(26)27-17-6-7-18(2)3/h9-12,18,21H,4-8,13-17H2,1-3H3
InChI Key
KYKLTCCROSYIJR-UHFFFAOYSA-N
Formula
C23H35NO3
SMILES
CCCCc1ccc(C(=O)N2CCC(C(=O)OCCCC(C)C)CC2)cc1
Molecular Weight1
373.53
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Physical Properties

Property Value Unit Source
log10WS -5.72 Crippen Calculated Property
logPoct/wat 4.861 Crippen Calculated Property
McVol 319.300 ml/mol McGowan Calculated Property
Inp [3069.00; 3069.00]   Show Hide
Inp 3069.00 NIST
Inp 3069.00 NIST

Similar Compounds

Isonipecotic acid, N-(4-butylbenzoyl)-, pentyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, hexyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, heptyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, decyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, nonyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, octyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, butyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, isobutyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, propyl ester. Isonipecotic acid, N-(4-butylbenzoyl)-, ethyl ester. Isonipecotic acid, N-(4-ethylbenzoyl)-, isohexyl ester. Isonipecotic acid, N-(4-ethylbenzoyl)-, hexyl ester. Isonipecotic acid, N-(4-ethylbenzoyl)-, heptyl ester. Isonipecotic acid, N-(4-ethylbenzoyl)-, pentyl ester. Isonipecotic acid, N-(4-ethylbenzoyl)-, tridecyl ester.

Find more compounds similar to Isonipecotic acid, N-(4-butylbenzoyl)-, isohexyl ester.

Sources

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