Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1H-Azepine-1-acetonitrile, hexahydro-
RN: 54714-50-0
InChIKey: OHKGIEVCPHMZKY-UHFFFAOYSA-N

Molecular Formula

  • C8-H14-N2

Molecular Weight

  • 138.213
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 4-20-00-01431 (Beilstein Handbook Reference)
  • Acetonitrile, (hexahydro-1H-azepin-1-yl)-
  • BRN 0110233
  • EINECS 259-302-8
  • Hexahydro-1H-azepine-1-acetonitrile
  • NSC 74468

Systematic Names

  • 1H-Azepine-1-acetonitrile, hexahydro-
  • Hexahydro-1H-azepine-1-acetonitrile

Registry Numbers

CAS Registry Number

  • 54714-50-0

System Generated Number

  • 0054714500

Structure Descriptors

InChI

1S/C8H14N2/c9-5-8-10-6-3-1-2-4-7-10/h1-4,6-8H2

InChIKey

OHKGIEVCPHMZKY-UHFFFAOYSA-N

Smiles

N1(CCCCCC1)CC#N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#07820,