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Substance Name: 2,4,5-Triiodoimidazole
RN: 1746-25-4
InChIKey: HIDCNJIBRZBEPN-UHFFFAOYSA-N

Molecular Formula

  • C3-H-I3-N2

Molecular Weight

  • 445.755
 
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Names and Synonyms

Name of Substance

  • 2,4,5-Triiodoimidazole

Synonyms

  • 2,4,5-Triiodoimidazole
  • 5-23-04-00471 (Beilstein Handbook Reference)
  • BRN 0115451
  • Imidazole, 2,4,5-triiodo-
  • NSC 222411

Systematic Names

  • 1H-Imidazole, 2,4,5-triiodo- (9CI)
  • Imidazole, 2,4,5-triiodo-

Registry Numbers

CAS Registry Number

  • 1746-25-4

System Generated Number

  • 0001746254

Structure Descriptors

InChI

1S/C3HI3N2/c4-1-2(5)8-3(6)7-1/h(H,7,8)

InChIKey

HIDCNJIBRZBEPN-UHFFFAOYSA-N

Smiles

n1c([nH]c(c1I)I)I

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 100mg/kg (100mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#05102,
rat LD50 oral 278mg/kg (278mg/kg)   Toxicology and Applied Pharmacology. Vol. 89, Pg. 175, 1987.
rat LD50 oral 278mg/kg (278mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Toxicology and Applied Pharmacology. Vol. 89, Pg. 175, 1987.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.78 (none)   EXP
Water Solubility 6.700 mg/L 25 EST
Vapor Pressure 2.62E-07 mm Hg 25 EST
Henry's Law Constant 4.68E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.60E-11 cm3/molecule-sec 25 EST

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