Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2-Butanone, 1-chloro-4-(N-(3-chloro-2-oxopropyl)-N-nitroamino)-
RN: 39498-67-4
InChIKey: REHIJDHUXKPVLK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H10-Cl2-O4

Molecular Weight

  • 257.072
 
* 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

Synonym

  • 1-Chloro-4-(N-(3-chloro-2-oxopropyl)N-nitroamino)-2-butanone

Systematic Name

  • 2-Butanone, 1-chloro-4-(N-(3-chloro-2-oxopropyl)-N-nitroamino)-

Registry Numbers

CAS Registry Number

  • 39498-67-4

System Generated Number

  • 0039498674

Structure Descriptors

InChI

1S/C7H10Cl2N2O4/c8-3-6(12)1-2-10(11(14)15)5-7(13)4-9/h1-5H2

InChIKey

REHIJDHUXKPVLK-UHFFFAOYSA-N

Smiles

C(CN(CC(=O)CCl)[N+](=O)[O-])C(=O)CCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 11mg/kg (11mg/kg)   Pharmaceutical Chemistry Journal Vol. 10, Pg. 1504, 1976.