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Substance Name: 2-Butanone, 4-(hexahydro-1H-azepin-1-yl)-, hydrochloride
RN: 111472-70-9
InChIKey: INUXMLQXVLOVNR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H19-N-O.Cl-H

Molecular Weight

  • 205.727
 
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Names and Synonyms

Synonyms

  • 4-(Hexahydro-1H-azepin-1-yl)-2-butanone hydrochloride
  • TG-1

Systematic Name

  • 2-Butanone, 4-(hexahydro-1H-azepin-1-yl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 111472-70-9

System Generated Number

  • 0111472709

Molecular Formulas

Molecular Formula

  • C10-H19-N-O.Cl-H

Molecular Formula Fragments

  • C10-H19-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C10H19NO.ClH/c1-10(12)6-9-11-7-4-2-3-5-8-11;/h2-9H2,1H3;1H

InChIKey

INUXMLQXVLOVNR-UHFFFAOYSA-N

Smiles

[NH+]1(CCC(C)=O)CCCCCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo subcutaneous 100mg/kg (100mg/kg)   Farmakologiya i Toksikologiya Vol. 25, Pg. 437, 1962.