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Substance Name: 2-Thiazolamine, N-2-imidazolidinylidene-5-nitro-
RN: 24240-69-5
InChIKey: GOKRGKAACKWNNZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H7-N5-O2-S

Molecular Weight

  • 213.2203
 
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Names and Synonyms

Synonyms

  • 2-(1,3-Imidazolinyliden-(2)-amino)-5-nitrothiazol
  • 2-(1,3-Imidazolinyliden-(2)-amino)-5-nitrothiazol [German]
  • BRN 0988771
  • N-2-Imidazolidinylidene-5-nitro-2-thiazolamine

Systematic Name

  • 2-Thiazolamine, N-2-imidazolidinylidene-5-nitro-

Registry Numbers

CAS Registry Number

  • 24240-69-5

System Generated Number

  • 0024240695

Structure Descriptors

InChI

1S/C6H7N5O2S/c12-11(13)4-3-9-6(14-4)10-5-7-1-2-8-5/h3H,1-2H2,(H2,7,8,9,10)

InChIKey

GOKRGKAACKWNNZ-UHFFFAOYSA-N

Smiles

c1c(sc(n1)N=C2NCCN2)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 4gm/kg (4000mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 22, Pg. 1045, 1972.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 1.38 (none)   EXP
Water Solubility 1.03E+04 mg/L 25 EST
Vapor Pressure 2.10E-06 mm Hg 25 EST
Henry's Law Constant 7.69E-17 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.40E-10 cm3/molecule-sec 25 EST

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