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Substance Name: Benzenemethanamine, 2-((3,4-dimethoxyphenyl)thio)-, hydrochloride
RN: 127906-03-0
InChIKey: BKPIKQAZHPYFLV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H17-N-O2-S.Cl-H

Molecular Weight

  • 311.8312
 
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Names and Synonyms

Synonym

  • 2-((3,4-Dimethoxyphenyl)thio)benzenemethanamine hydrochloride

Systematic Name

  • Benzenemethanamine, 2-((3,4-dimethoxyphenyl)thio)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 127906-03-0

System Generated Number

  • 0127906030

Molecular Formulas

Molecular Formula

  • C15-H17-N-O2-S.Cl-H

Molecular Formula Fragments

  • C15-H17-N-O2-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H17NO2S.ClH/c1-17-13-8-7-12(9-14(13)18-2)19-15-6-4-3-5-11(15)10-16;/h3-9H,10,16H2,1-2H3;1H

InChIKey

BKPIKQAZHPYFLV-UHFFFAOYSA-N

Smiles

COc1ccc(cc1OC)Sc2ccccc2CN.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 57mg/kg (57mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 54, Pg. 3294, 1989.