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Substance Name: 1-Propanone, 2-((1,1-dimethylethyl)amino)-1-(3-fluorophenyl)-, hydrochloride
RN: 34841-38-8
InChIKey: QUJAQRVWZWXPEE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H18-F-N-O.Cl-H

Molecular Weight

  • 259.75
 
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Names and Synonyms

Synonyms

  • 2-((1,1-Dimethylethyl)amino)-1-(3-fluorophenyl)-1-propanone hydrochloride
  • Propiophenone, 2-(tert-butylamino)-3'-fluoro-, hydrochloride

Systematic Name

  • 1-Propanone, 2-((1,1-dimethylethyl)amino)-1-(3-fluorophenyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 34841-38-8

System Generated Number

  • 0034841388

Molecular Formulas

Molecular Formula

  • C13-H18-F-N-O.Cl-H

Molecular Formula Fragments

  • C13-H18-F-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H18FNO.ClH/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10;/h5-9,15H,1-4H3;1H

InChIKey

QUJAQRVWZWXPEE-UHFFFAOYSA-N

Smiles

C([C@@H](C)NC(C)(C)C)(=O)c1cc(ccc1)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 230mg/kg (230mg/kg)   Pharmacological and Biochemical Properties of Drug Substances. Vol. 3, Pg. 1, 1981.