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Substance Name: Furazan, 3-methyl-4-nitro-, 2(or 5)-oxide
RN: 49558-02-3
InChIKey: RGZZPXRWOUTAPT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C3-H3-N3-O4

Molecular Weight

  • 145.074
 
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Names and Synonyms

Synonyms

  • 3-Methyl-4-nitro-furoxan
  • 3-Methyl-4-nitrofurazan 2(or 5)-oxide
  • 4-27-00-07095 (Beilstein Handbook Reference)
  • BRN 0155091

Systematic Name

  • Furazan, 3-methyl-4-nitro-, 2(or 5)-oxide

Registry Numbers

CAS Registry Number

  • 49558-02-3

System Generated Number

  • 0049558023

Structure Descriptors

InChI

1S/C3H3N3O4/c1-2-3(5(7)8)4-10-6(2)9/h1H3

InChIKey

RGZZPXRWOUTAPT-UHFFFAOYSA-N

Smiles

c1(c(n(=O)on1)C)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 199mg/kg (199mg/kg) LUNGS, THORAX, OR RESPIRATION: CYANOSIS

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Pharmacological Research Communications. Vol. 8, Pg. 253, 1976.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 0.78 (none)   EXP
Water Solubility 7000 mg/L 25 EST
Vapor Pressure 5.56E-04 mm Hg 25 EST
Henry's Law Constant 8.24E-12 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.14E-12 cm3/molecule-sec 25 EST

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