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Substance Name: Benzenemethanethiol, alpha-(aminomethyl)-, hydrochloride
RN: 3852-66-2
InChIKey: LSPIWVYEIPDWBS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H11-N-S.Cl-H

Molecular Weight

  • 189.709
 
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Names and Synonyms

Synonyms

  • 1-Phenyl-2-aminoethylmercaptan hydrochloride
  • alpha-(Aminomethyl)benzenemethanethiol hydrochloride

Systematic Name

  • Benzenemethanethiol, alpha-(aminomethyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 3852-66-2

System Generated Number

  • 0003852662

Molecular Formulas

Molecular Formula

  • C8-H11-N-S.Cl-H

Molecular Formula Fragments

  • C8-H11-N-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C8H11NS.ClH/c9-6-8(10)7-4-2-1-3-5-7;/h1-5,8,10H,6,9H2;1H

InChIKey

LSPIWVYEIPDWBS-UHFFFAOYSA-N

Smiles

c1(ccccc1)[C@@H](S)CN.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 189mg/kg (189mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 97, Pg. 1117, 1977.
mouse LD50 subcutaneous 263mg/kg (263mg/kg)   Pharmaceutical Chemistry Journal Vol. 22, Pg. 857, 1988.