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Substance Name: Indole, 3-(1H-azepinylmethyl)-6-nitro-, hydrochloride
RN: 101832-86-4
InChIKey: UWNMAXDIFWCFBC-UHFFFAOYSA-N

Molecular Formula

  • C15-H19-N3-O2.Cl-H

Molecular Weight

  • 309.795
 
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Names and Synonyms

Synonym

  • 6-Nitro-3-(hexamethyleneiminomethyl)indole hydrochloride

Systematic Name

  • Indole, 3-(1H-azepinylmethyl)-6-nitro-, hydrochloride

Registry Numbers

CAS Registry Number

  • 101832-86-4

System Generated Number

  • 0101832864

Molecular Formulas

Molecular Formula

  • C15-H19-N3-O2.Cl-H

Molecular Formula Fragments

  • C15-H19-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H19N3O2.ClH/c19-18(20)13-5-6-14-12(10-16-15(14)9-13)11-17-7-3-1-2-4-8-17;/h5-6,9-10,16H,1-4,7-8,11H2;1H

InChIKey

UWNMAXDIFWCFBC-UHFFFAOYSA-N

Smiles

c12c(cc([N+](=O)[O-])cc2)[nH]cc1C[NH+]1CCCCCC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 11mg/kg (11mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#12477,