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Substance Name: Acetophenone, 2'-(2-(diisopropylamino)ethoxy)-, hydrochloride
RN: 20809-19-2
InChIKey: YTJZTHYYKZAJRC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H25-N-O2.Cl-H

Molecular Weight

  • 299.839
 
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Names and Synonyms

Synonyms

  • 2-Acetyl-beta-(N,N-diisopropyl)phenoxyethylamine, hydrochloride
  • Acetophenone, 6'-(2-(diisopropylamino)ethoxy)-, hydrochloride

Systematic Name

  • Acetophenone, 2'-(2-(diisopropylamino)ethoxy)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 20809-19-2

System Generated Number

  • 0020809192

Molecular Formulas

Molecular Formula

  • C16-H25-N-O2.Cl-H

Molecular Formula Fragments

  • C16-H25-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H25NO2.ClH/c1-12(2)17(13(3)4)10-11-19-16-9-7-6-8-15(16)14(5)18;/h6-9,12-13H,10-11H2,1-5H3;1H

InChIKey

YTJZTHYYKZAJRC-UHFFFAOYSA-N

Smiles

c1(c(OCC[NH+](C(C)C)C(C)C)cccc1)C(C)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 90mg/kg (90mg/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.