Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-
RN: 10526-63-3
InChIKey: GOFILDPHMQJATQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H14-N4-O8

Molecular Weight

  • 294.219
 
* 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

  • 4-04-00-03418 (Beilstein Handbook Reference)
  • BRN 1717015
  • N,N'-(1,2-Ethanediyl)bis(N-nitro-beta-alanine)

Systematic Name

  • beta-Alanine, N,N'-(1,2-ethanediyl)bis(N-nitro-

Registry Numbers

CAS Registry Number

  • 10526-63-3

System Generated Number

  • 0010526633

Structure Descriptors

InChI

1S/C8H14N4O8/c13-7(14)1-3-9(11(17)18)5-6-10(12(19)20)4-2-8(15)16/h1-6H2,(H,13,14)(H,15,16)

InChIKey

GOFILDPHMQJATQ-UHFFFAOYSA-N

Smiles

N(CCN(CCC(O)=O)[N+](=O)[O-])(CCC(O)=O)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 390mg/kg (390mg/kg)   Pharmaceutical Chemistry Journal Vol. 10, Pg. 1504, 1976.