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Substance Name: Acetophenone, 4'-(2-(dimethylamino)ethoxy)-2'-hydroxy-, hydrochloride
RN: 20809-03-4
InChIKey: CQPMRCVWKOILCP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H17-N-O3.Cl-H

Molecular Weight

  • 259.731
 
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Names and Synonyms

Synonyms

  • 4-Acetyl-3-hydroxy-beta-(N,N-dimethyl)phenoxyethylamine, hydrochloride
  • Acetophenone, 4'-(2-(dimethylamino)ethoxy)-6'-hydroxy-, hydrochloride

Systematic Name

  • Acetophenone, 4'-(2-(dimethylamino)ethoxy)-2'-hydroxy-, hydrochloride

Registry Numbers

CAS Registry Number

  • 20809-03-4

System Generated Number

  • 0020809034

Molecular Formulas

Molecular Formula

  • C12-H17-N-O3.Cl-H

Molecular Formula Fragments

  • C12-H17-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H17NO3.ClH/c1-9(14)11-5-4-10(8-12(11)15)16-7-6-13(2)3;/h4-5,8,15H,6-7H2,1-3H3;1H

InChIKey

CQPMRCVWKOILCP-UHFFFAOYSA-N

Smiles

c1(cc(c(C(C)=O)cc1)O)OCC[NH+](C)C.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 270mg/kg (270mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Journal of Medicinal Chemistry. Vol. 10, Pg. 266, 1967.