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Substance Name: Benzenemethanol, alpha-(1-((1-methylethyl)amino)ethyl)-4-((1-methylethyl)thio)-, hydrochloride
RN: 54821-85-1
InChIKey: TWJAJVAMPOIPNI-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

Synonyms

  • alpha-(1-((1-Methylethyl)amino)ethyl)-4-((1-methylethyl)thio)benzenemethanol hydrochloride
  • Benzyl alcohol, alpha-(1-(isopropylamino)ethyl)-4-(isopropylthio)-, hydrochloride

Systematic Name

  • Benzenemethanol, alpha-(1-((1-methylethyl)amino)ethyl)-4-((1-methylethyl)thio)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 54821-85-1

System Generated Number

  • 0054821851

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/c1-10(2)16-12(5)15(17)13-6-8-14(9-7-13)18-11(3)4;/h6-12,15-17H,1-5H3;1H

InChIKey

TWJAJVAMPOIPNI-UHFFFAOYSA-N

Smiles

CC(C)NC(C)C(c1ccc(cc1)SC(C)C)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 630mg/kg (630mg/kg) VASCULAR: REGIONAL OR GENERAL ARTERIOLAR OR VENOUS DILATION German Offenlegungsschrift Patent Document. Vol. #2334404,