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Substance Name: Butyrophenone, 2-((hexahydro-1H-azepin-1-yl)methyl)-4'-methyl-, hydrochloride
RN: 111443-80-2
InChIKey: HZRIDNJQJALIEA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H27-N-O.Cl-H

Molecular Weight

  • 309.878
 
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Names and Synonyms

Synonyms

  • 2-((Hexahydro-1H-azepin-1-yl)methyl)-4'-methylbutyrophenone hydrochloride
  • TG-14

Systematic Name

  • Butyrophenone, 2-((hexahydro-1H-azepin-1-yl)methyl)-4'-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 111443-80-2

System Generated Number

  • 0111443802

Molecular Formulas

Molecular Formula

  • C18-H27-N-O.Cl-H

Molecular Formula Fragments

  • C18-H27-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H27NO.ClH/c1-3-16(14-19-12-6-4-5-7-13-19)18(20)17-10-8-15(2)9-11-17;/h8-11,16H,3-7,12-14H2,1-2H3;1H

InChIKey

HZRIDNJQJALIEA-UHFFFAOYSA-N

Smiles

c1(C([C@@H](C[NH+]2CCCCCC2)CC)=O)ccc(C)cc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo subcutaneous 500mg/kg (500mg/kg)   Farmakologiya i Toksikologiya Vol. 25, Pg. 437, 1962.