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Substance Name: 1-Piperidinepropanol, alpha-isopropyl-alpha-phenyl-, hydrochloride
RN: 63039-96-3
InChIKey: NYUUKUMPWCJVBF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H27-N-O.Cl-H

Molecular Weight

  • 297.8672
 
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Names and Synonyms

Synonyms

  • 1-(N-Piperidyl)-4-methyl-3-phenyl-3-pentanol, hydrochloride
  • 3-Pentanol, 4-methyl-3-phenyl-1-(piperidino)-, hydrochloride
  • alpha-Isopropyl-alpha-(2-piperidyl-ethyl) benzyl alcohol
  • Benzyl alcohol, alpha-isopropyl-alpha-(2-piperidyl-ethyl)-, hydrochloride

Systematic Name

  • 1-Piperidinepropanol, alpha-isopropyl-alpha-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 63039-96-3

System Generated Number

  • 0063039963

Molecular Formulas

Molecular Formula

  • C17-H27-N-O.Cl-H

Molecular Formula Fragments

  • C17-H27-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H27NO.ClH/c1-15(2)17(19,16-9-5-3-6-10-16)11-14-18-12-7-4-8-13-18;/h3,5-6,9-10,15,19H,4,7-8,11-14H2,1-2H3;1H

InChIKey

NYUUKUMPWCJVBF-UHFFFAOYSA-N

Smiles

CC(C)C(CCN1CCCCC1)(c2ccccc2)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 160mg/kg (160mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 96, Pg. 151, 1949.
mouse LD50 intravenous 36mg/kg (36mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 96, Pg. 151, 1949.
rat LD50 intraperitoneal 112mg/kg (112mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 96, Pg. 151, 1949.
rat LD50 intravenous 45mg/kg (45mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 96, Pg. 151, 1949.