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Substance Name: 1H-Benzimidazole, 5-chloro-2-phenyl-, hydrate
RN: 4926-65-2
InChIKey: OEQLKXIDRFCBML-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H9-Cl-N2.H2-O

Molecular Weight

  • 246.696
 
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Names and Synonyms

Synonym

  • 5-Chloro-2-phenyl-1H-benzimidazole hydrate

Systematic Name

  • 1H-Benzimidazole, 5-chloro-2-phenyl-, hydrate

Registry Numbers

CAS Registry Number

  • 4926-65-2

System Generated Number

  • 0004926652

Molecular Formulas

Molecular Formula

  • C13-H9-Cl-N2.H2-O

Molecular Formula Fragments

  • C13-H9-Cl-N2
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C13H9ClN2.H2O/c14-10-6-7-11-12(8-10)16-13(15-11)9-4-2-1-3-5-9;/h1-8H,(H,15,16);1H2

InChIKey

OEQLKXIDRFCBML-UHFFFAOYSA-N

Smiles

c1(c2ccccc2)[nH]c2ccc(cc2n1)Cl.O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 831mg/kg (831mg/kg)   Farmaco, Edizione Scientifica. Vol. 43, Pg. 215, 1988.