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Substance Name: Benzimidazole, 5-nitro-2-(trifluoromethyl)-
RN: 327-19-5
InChIKey: FEJRBJIEEALTTL-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Herbicide

Molecular Formula

  • C8-H4-F3-N3-O2

Molecular Weight

  • 231.133
 
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Names and Synonyms

Synonym

  • 5-Nitro-2-(trifluoromethyl)benzimidazole

Systematic Name

  • Benzimidazole, 5-nitro-2-(trifluoromethyl)-

Registry Numbers

CAS Registry Number

  • 327-19-5

System Generated Number

  • 0000327195

Structure Descriptors

InChI

1S/C8H4F3N3O2/c9-8(10,11)7-12-5-2-1-4(14(15)16)3-6(5)13-7/h1-3H,(H,12,13)

InChIKey

FEJRBJIEEALTTL-UHFFFAOYSA-N

Smiles

c1(nc2cc([N+]([O-])=O)ccc2[nH]1)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 3663ug/kg (3.663mg/kg)   Pesticide Science. Vol. 15, Pg. 31, 1984.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.68 (none)   EXP
Water Solubility 62.9 mg/L 25 EST
Vapor Pressure 6.75E-07 mm Hg 25 EST
Henry's Law Constant 1.26E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.56E-13 cm3/molecule-sec 25 EST

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