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Substance Name: 1H-Benzimidazole, 5,6-dichloro-2-(trifluoromethyl)-
RN: 2338-25-2
InChIKey: KUMRUFFLHYXFLV-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C8-H3-Cl2-F3-N2

Molecular Weight

  • 255.026
 
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Names and Synonyms

Synonyms

  • 5,6-Dichloro-2-trifluoromethylbenzimidazole
  • 5-23-06-00354 (Beilstein Handbook Reference)
  • BRN 0616085
  • NC 2983

Systematic Name

  • 1H-Benzimidazole, 5,6-dichloro-2-(trifluoromethyl)-

Registry Numbers

CAS Registry Number

  • 2338-25-2

System Generated Number

  • 0002338252

Structure Descriptors

InChI

1S/C8H3Cl2F3N2/c9-3-1-5-6(2-4(3)10)15-7(14-5)8(11,12)13/h1-2H,(H,14,15)

InChIKey

KUMRUFFLHYXFLV-UHFFFAOYSA-N

Smiles

C(c1[nH]c2cc(Cl)c(cc2n1)Cl)(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 35mg/kg (35mg/kg)   Biochemical Pharmacology. Vol. 18, Pg. 1389, 1969.
rat LD50 oral 7881ug/kg (7.881mg/kg)   Pesticide Science. Vol. 15, Pg. 31, 1984.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.49 (none)   EXP
Water Solubility 23.2 mg/L 25 EST
Vapor Pressure 2.90E-06 mm Hg 25 EST
Henry's Law Constant 1.75E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.29E-12 cm3/molecule-sec 25 EST

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