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Substance Name: 3-Pyrrolidinol, 3-(alpha,alpha,alpha-trifluoro-m-tolyl)-, hydrochloride
RN: 1744-48-5
InChIKey: CCMJKBIBIGSUIZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H12-F3-N-O.Cl-H

Molecular Weight

  • 267.677
 
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Names and Synonyms

Synonym

  • 3-(alpha,alpha,alpha-Trifluoro-m-tolyl)-3-pyrrolidinol hydrochloride

Systematic Name

  • 3-Pyrrolidinol, 3-(alpha,alpha,alpha-trifluoro-m-tolyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 1744-48-5

System Generated Number

  • 0001744485

Molecular Formulas

Molecular Formula

  • C11-H12-F3-N-O.Cl-H

Molecular Formula Fragments

  • C11-H12-F3-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C11H12F3NO.ClH/c12-11(13,14)9-3-1-8(2-4-9)10(16)5-6-15-7-10;/h1-4,15-16H,5-7H2;1H

InChIKey

CCMJKBIBIGSUIZ-UHFFFAOYSA-N

Smiles

C1CNC[C@@]1(c1ccc(cc1)C(F)(F)F)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 855mg/kg (855mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 60, 1964.