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Substance Name: 1-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenyl)-3-(4-(1,1-dimethylethyl)phenyl)-, hydrochloride
RN: 22908-74-3
InChIKey: OLUVWTIXXJWCTN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H35-N-O2.Cl-H

Molecular Weight

  • 418.017
 
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Names and Synonyms

Synonym

  • 1-(2-(2-(Diethylamino)ethoxy)phenyl)-3-(4-(1,1-dimethylethyl)phenyl)-1-propanone HCl

Systematic Name

  • 1-Propanone, 1-(2-(2-(diethylamino)ethoxy)phenyl)-3-(4-(1,1-dimethylethyl)phenyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 22908-74-3

System Generated Number

  • 0022908743

Molecular Formulas

Molecular Formula

  • C25-H35-N-O2.Cl-H

Molecular Formula Fragments

  • C25-H35-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H35NO2.ClH/c1-6-26(7-2)18-19-28-24-11-9-8-10-22(24)23(27)17-14-20-12-15-21(16-13-20)25(3,4)5;/h8-13,15-16H,6-7,14,17-19H2,1-5H3;1H

InChIKey

OLUVWTIXXJWCTN-UHFFFAOYSA-N

Smiles

C(CCc1ccc(cc1)C(C)(C)C)(=O)c1c(cccc1)OCCN(CC)CC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 66mg/kg (66mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 966, 1989.
mouse LD50 subcutaneous 362mg/kg (362mg/kg)   Pharmaceutical Chemistry Journal Vol. 21, Pg. 646, 1987.
rat LD50 intravenous 60mg/kg (60mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 966, 1989.