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Substance Name: Propiophenone, 4'-ethoxy-2-methyl-3-(hexahydro-1-azepinyl)-, hydrochloride
RN: 27922-15-2
InChIKey: MUTVFUVADAPUHJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H27-N-O2.Cl-H

Molecular Weight

  • 325.877
 
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Names and Synonyms

Synonyms

  • 4'-Ethoxy-2-methyl-3-(hexahydro-1-azepinyl)propiophenone hydrochloride
  • 4'-Ethoxy-2-methyl-3-(hexamethyleneimino)propiophenone hydrochloride

Systematic Name

  • Propiophenone, 4'-ethoxy-2-methyl-3-(hexahydro-1-azepinyl)-, hydrochloride

Registry Numbers

CAS Registry Number

  • 27922-15-2

System Generated Number

  • 0027922152

Molecular Formulas

Molecular Formula

  • C18-H27-N-O2.Cl-H

Molecular Formula Fragments

  • C18-H27-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C18H27NO2.ClH/c1-3-21-17-10-8-16(9-11-17)18(20)15(2)14-19-12-6-4-5-7-13-19;/h8-11,15H,3-7,12-14H2,1-2H3;1H

InChIKey

MUTVFUVADAPUHJ-UHFFFAOYSA-N

Smiles

C([C@@H](CN1CCCCCC1)C)(=O)c1ccc(cc1)OCC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 480, 1970.