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Substance Name: 5-Hexynophenone, 4'-fluoro-2-morpholinomethyl-, hydrochloride
RN: 29229-75-2
InChIKey: CUJZTIQIZKZNHN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H21-F-N-O2.Cl-H

Molecular Weight

  • 325.809
 
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Names and Synonyms

Synonym

  • 4'-Fluoro-2-morpholinomethyl-5-hexynophenone hydrochloride

Systematic Name

  • 5-Hexynophenone, 4'-fluoro-2-morpholinomethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 29229-75-2

System Generated Number

  • 0029229752

Molecular Formulas

Molecular Formula

  • C17-H21-F-N-O2.Cl-H

Molecular Formula Fragments

  • C17-H21-F-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H20FNO2.ClH/c1-2-3-4-15(13-19-9-11-21-12-10-19)17(20)14-5-7-16(18)8-6-14;/h1,5-8,15H,3-4,9-13H2;1H

InChIKey

CUJZTIQIZKZNHN-UHFFFAOYSA-N

Smiles

C([C@@H](C[NH+]1CCOCC1)CCC#C)(c1ccc(F)cc1)=O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 460mg/kg (460mg/kg)   Chimica Therapeutica. Vol. 8, Pg. 14, 1973.