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Substance Name: 1-Piperidineethanethiol, alpha-phenyl-, hydrochloride
RN: 1017-26-1
InChIKey: PJIJPPRRVDBJHI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H19-N-S.Cl-H

Molecular Weight

  • 257.827
 
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Names and Synonyms

Synonym

  • alpha-Phenyl-1-piperidineethanethiol hydrochloride

Systematic Name

  • 1-Piperidineethanethiol, alpha-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 1017-26-1

System Generated Number

  • 0001017261

Molecular Formulas

Molecular Formula

  • C13-H19-N-S.Cl-H

Molecular Formula Fragments

  • C13-H19-N-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H19NS.ClH/c15-13(12-7-3-1-4-8-12)11-14-9-5-2-6-10-14;/h1,3-4,7-8,13,15H,2,5-6,9-11H2;1H

InChIKey

PJIJPPRRVDBJHI-UHFFFAOYSA-N

Smiles

C1CCCN(C1)C[C@@H](S)c1ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 129mg/kg (129mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 97, Pg. 1117, 1977.