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Substance Name: Benzenemethanol, alpha-(((1,1-dimethylethyl)amino)methyl)-4-fluoro-, hydrochloride
RN: 85540-78-9
InChIKey: YTWSXMSQRZJJCN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-F-N-O.Cl-H

Molecular Weight

  • 247.7391
 
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Names and Synonyms

Synonyms

  • 1-(4-Fluorophenyl)-2-tertiary-butylamino-1-ethanol hydrochloride
  • alpha-(((1,1-Dimethylethyl)amino)methyl)-4-fluorobenzenemethanol hydrochloride
  • CRL 40854

Systematic Name

  • Benzenemethanol, alpha-(((1,1-dimethylethyl)amino)methyl)-4-fluoro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 85540-78-9

System Generated Number

  • 0085540789

Molecular Formulas

Molecular Formula

  • C12-H18-F-N-O.Cl-H

Molecular Formula Fragments

  • C12-H18-F-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H18FNO.ClH/c1-12(2,3)14-8-11(15)9-4-6-10(13)7-5-9;/h4-7,11,14-15H,8H2,1-3H3;1H

InChIKey

YTWSXMSQRZJJCN-UHFFFAOYSA-N

Smiles

CC(C)(C)NCC(c1ccc(cc1)F)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 128mg/kg (128mg/kg)   United States Patent Document. Vol. #4861801,