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Substance Name: Phenol, 2-((2-(aminomethyl)phenyl)thio)-, hydrochloride
RN: 127906-49-4
InChIKey: DWBJDYCTRIEKMD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H13-N-O-S.Cl-H

Molecular Weight

  • 267.7786
 
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Names and Synonyms

Synonym

  • 2-((2-(Aminomethyl)phenyl)thio)phenol hydrochloride

Systematic Name

  • Phenol, 2-((2-(aminomethyl)phenyl)thio)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 127906-49-4

System Generated Number

  • 0127906494

Molecular Formulas

Molecular Formula

  • C13-H13-N-O-S.Cl-H

Molecular Formula Fragments

  • C13-H13-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H13NOS.ClH/c14-9-10-5-1-3-7-12(10)16-13-8-4-2-6-11(13)15;/h1-8,15H,9,14H2;1H

InChIKey

DWBJDYCTRIEKMD-UHFFFAOYSA-N

Smiles

c1ccc(c(c1)CN)Sc2ccccc2O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 579mg/kg (579mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 54, Pg. 3294, 1989.