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Structure

2-(2-Bromophenyl)-1H-benzimidazole

CAS
13275-42-8
Catalog Number
ACM13275428
Category
Other Products
Molecular Weight
273.13
Molecular Formula
C13H9BrN2

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Specification

Synonyms
2-(2-Bromophenyl)-1H-1,3-benzodiazole
IUPAC Name
2-(2-bromophenyl)-1H-benzimidazole
Canonical SMILES
C1=CC=C(C(=C1)C2=NC3=CC=CC=C3N2)Br
InChI
InChI=1S/C13H9BrN2/c14-10-6-2-1-5-9(10)13-15-11-7-3-4-8-12(11)16-13/h1-8H,(H,15,16)
InChI Key
KOXRUUGKLDCECO-UHFFFAOYSA-N
Boiling Point
446.6ºC at 760 mmHg
Melting Point
242 °C
Flash Point
223.9ºC
Density
1.546g/cm³
Appearance
White to Yellow to Orange powder to crystal
Exact Mass
271.99500
Hazard Statements
H413 : May cause long lasting harmful effects to aquatic life.
H-Bond Acceptor
1
H-Bond Donor
1
MDL Number
MFCD00449969
Precautionary Statements
P501 : Dispose of contents/ container to an approved waste disposal plant.P273 : Avoid release to the environment.

Upstream Synthesis Route 1

  • 95-54-5
  • 88-65-3
  • 13275-42-8

Reference: [1]Phosphorus, Sulfur and Silicon and the Related Elements,2009,vol. 184,p. 147 - 155

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