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Substance Name: Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride
RN: 38920-69-3
InChIKey: VPOCCJCAVCNUFN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H25-N-O-S.Cl-H

Molecular Weight

  • 303.8954
 
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Names and Synonyms

Synonym

  • 2-((6-(o-Tolyloxy)hexyl)amino)ethanethiol hydrochloride

Systematic Name

  • Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 38920-69-3

System Generated Number

  • 0038920693

Molecular Formulas

Molecular Formula

  • C15-H25-N-O-S.Cl-H

Molecular Formula Fragments

  • C15-H25-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H25NOS.ClH/c1-14-8-4-5-9-15(14)17-12-7-3-2-6-10-16-11-13-18;/h4-5,8-9,16,18H,2-3,6-7,10-13H2,1H3;1H

InChIKey

VPOCCJCAVCNUFN-UHFFFAOYSA-N

Smiles

Cc1ccccc1OCCCCCCNCCS.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Journal of Medicinal Chemistry. Vol. 15, Pg. 968, 1972.