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Substance Name: Cyclobutanemethanethiol, 2-amino-, hydrochloride, (E)-
RN: 55217-61-3
InChIKey: AQWXWWDWJQADPU-UYXJWNHNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C5-H11-N-S.Cl-H

Molecular Weight

  • 153.676
 
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Names and Synonyms

Synonyms

  • (trans)-2-Mercaptomethylcyclobutylamine hydrochloride
  • trans-1-Amino-2-mercaptomethylcyclobutane hydrochloride

Systematic Name

  • Cyclobutanemethanethiol, 2-amino-, hydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 55217-61-3

System Generated Number

  • 0055217613

Molecular Formulas

Molecular Formula

  • C5-H11-N-S.Cl-H

Molecular Formula Fragments

  • C5-H11-N-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C5H11NS.ClH/c6-5-2-1-4(5)3-7;/h4-5,7H,1-3,6H2;1H/t4-,5+;/m0./s1

InChIKey

AQWXWWDWJQADPU-UYXJWNHNSA-N

Smiles

C1[C@H]([C@@H](C1)N)CS.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 323, 1975.
mouse LD50 oral 500mg/kg (500mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 323, 1975.