Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Methane, dichlorodinitro-
RN: 1587-41-3
InChIKey: VLWDJCZBZPKOGX-UHFFFAOYSA-N

Molecular Formula

  • C-Cl2-N2-O4

Molecular Weight

  • 174.927
 
* 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

  • 3-01-00-00115 (Beilstein Handbook Reference)
  • BRN 1772861
  • Dichlorodinitromethane

Systematic Name

  • Methane, dichlorodinitro-

Registry Numbers

CAS Registry Number

  • 1587-41-3

System Generated Number

  • 0001587413

Structure Descriptors

InChI

1S/CCl2N2O4/c2-1(3,4(6)7)5(8)9

InChIKey

VLWDJCZBZPKOGX-UHFFFAOYSA-N

Smiles

C([N+](=O)[O-])([N+](=O)[O-])(Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LDLo intraperitoneal 500mg/kg (500mg/kg) BLOOD: METHEMOGLOBINEMIA-CARBOXYHEMOGLOBIN Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. Vol. 171, Pg. 1396, 1920.
mouse LD50 intraperitoneal 20mg/kg (20mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 10(6), Pg. 53, 1976.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 121.5 deg C   EXP
log P (octanol-water) 0.200 (none)   EST
Atmospheric OH Rate Constant 2.60E-13 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.