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Substance Name: Ketone, 3-(2-methylpiperidino)propyl phenyl, hydrochloride
RN: 51167-86-3
InChIKey: KIFAGHRXQUQMRU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H23-N-O.Cl-H

Molecular Weight

  • 281.825
 
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Names and Synonyms

Synonym

  • Butyrophenone, 4-(2-methylpiperidino)-, hydrochloride

Systematic Name

  • Ketone, 3-(2-methylpiperidino)propyl phenyl, hydrochloride

Registry Numbers

CAS Registry Number

  • 51167-86-3

System Generated Number

  • 0051167863

Molecular Formulas

Molecular Formula

  • C16-H23-N-O.Cl-H

Molecular Formula Fragments

  • C16-H23-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H23NO.ClH/c1-14-8-5-6-12-17(14)13-7-11-16(18)15-9-3-2-4-10-15;/h2-4,9-10,14H,5-8,11-13H2,1H3;1H

InChIKey

KIFAGHRXQUQMRU-UHFFFAOYSA-N

Smiles

C([N@@H+]1[C@@H](CCCC1)C)CCC(c1ccccc1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 32mg/kg (32mg/kg)   Journal of the American Chemical Society. Vol. 68, Pg. 2592, 1946.