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Substance Name: Morpholine, 4-butyl-2-(alpha,alpha,alpha-trifluoro-m-tolyl)-, hydrochloride
RN: 26629-94-7
InChIKey: XKFYUVMWLVEYOL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H20-F3-N-O.Cl-H

Molecular Weight

  • 323.784
 
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Names and Synonyms

Synonym

  • 4-Butyl-2-(alpha,alpha,alpha-trifluoro-m-tolyl)morpholine hydrochloride

Systematic Name

  • Morpholine, 4-butyl-2-(alpha,alpha,alpha-trifluoro-m-tolyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 26629-94-7

System Generated Number

  • 0026629947

Molecular Formulas

Molecular Formula

  • C15-H20-F3-N-O.Cl-H

Molecular Formula Fragments

  • C15-H20-F3-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H20F3NO.ClH/c1-2-3-7-19-8-9-20-14(11-19)12-5-4-6-13(10-12)15(16,17)18;/h4-6,10,14H,2-3,7-9,11H2,1H3;1H

InChIKey

XKFYUVMWLVEYOL-UHFFFAOYSA-N

Smiles

C1[C@@H](OCC[N@@]1CCCC)c1cc(ccc1)C(F)(F)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1730mg/kg (1730mg/kg)   United States Patent Document. Vol. #3637680,