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Substance Name: Acetophenone, 4'-(hexahydro-1H-azepinyl)carbonylmethoxy-
RN: 29936-71-8
InChIKey: DMQAICWZFPRRFO-UHFFFAOYSA-N

Molecular Formula

  • C16-H21-N-O3

Molecular Weight

  • 275.346
 
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Names and Synonyms

Synonyms

  • 1H-Azepine, hexahydro-1-(2-(p-acetylphenoxy)acetyl)-
  • 4'-(Hexahydro-1H-azepinyl)carbonylmethoxyacetophenone
  • 5-20-04-00036 (Beilstein Handbook Reference)
  • BRN 1623790

Systematic Name

  • Acetophenone, 4'-(hexahydro-1H-azepinyl)carbonylmethoxy-

Registry Numbers

CAS Registry Number

  • 29936-71-8

System Generated Number

  • 0029936718

Structure Descriptors

InChI

1S/C16H21NO3/c1-13(18)14-6-8-15(9-7-14)20-12-16(19)17-10-4-2-3-5-11-17/h6-9H,2-5,10-12H2,1H3

InChIKey

DMQAICWZFPRRFO-UHFFFAOYSA-N

Smiles

c1(ccc(C(C)=O)cc1)OCC(N1CCCCCC1)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 300mg/kg (300mg/kg)   Chimica Therapeutica. Vol. 8, Pg. 574, 1973.