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Substance Name: 1-Piperidinepropanol, 2-(4-phenylbutyl)-, benzoate, hydrochloride
RN: 102207-13-6
InChIKey: JDOFBGVVJFCKBL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H33-N-O2.Cl-H

Molecular Weight

  • 416.0016
 
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Names and Synonyms

Synonyms

  • 3-(2-(4-Phenylbutyl)piperidino)propyl benzoate hydrochloride
  • Benzoic acid, 3-(2-(p-butylphenyl)piperidino)propyl ester hydrochloride

Systematic Name

  • 1-Piperidinepropanol, 2-(4-phenylbutyl)-, benzoate, hydrochloride

Registry Numbers

CAS Registry Number

  • 102207-13-6

System Generated Number

  • 0102207136

Molecular Formulas

Molecular Formula

  • C25-H33-N-O2.Cl-H

Molecular Formula Fragments

  • C25-H33-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H33NO2.ClH/c27-25(23-15-5-2-6-16-23)28-21-11-20-26-19-10-9-18-24(26)17-8-7-14-22-12-3-1-4-13-22;/h1-6,12-13,15-16,24H,7-11,14,17-21H2;1H

InChIKey

JDOFBGVVJFCKBL-UHFFFAOYSA-N

Smiles

C(c1ccccc1)(=O)OCCC[N@@]1[C@@H](CCCC1)CCCCc1ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo intravenous 28mg/kg (28mg/kg)   Journal of the American Chemical Society. Vol. 55, Pg. 4625, 1933.