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Home > Encyclopedia > 1-(1H-Benzimidazol-2-yl)-2,2-dibromoethanone

1-(1H-Benzimidazol-2-yl)-2,2-dibromoethanone

1-(1H-Benzimidazol-2-yl)-2,2-dibromoethanone structure

1-(1H-Benzimidazol-2-yl)-2,2-dibromoethanone 

structure
  • CAS No:

    56653-42-0

  • Formula:

    C9H6Br2N2O

  • Chemical Name:

    1-(1H-Benzimidazol-2-yl)-2,2-dibromoethanone

  • Synonyms:

    Ethanone,1-(1H-benzimidazol-2-yl)-2,2-dibromo-;1-(1H-Benzimidazol-2-yl)-2,2-dibromoethanone;1-(1H-1,3-Benzodiazol-2-yl)-2,2-dibromoethan-1-one

1-(1H-Benzimidazol-2-yl)-2,2-dibromoethanone Basic Attributes

398.879

317.96

DTXSID50480878

Characteristics

45.8

3.81960

2.073

171-173 °C @ Solvent: Ethanol

399.3ºC at 760 mmHg

195.3ºC

1.743

1-(1H-Benzimidazol-2-yl)-2,2-dibromoethanone Use and Manufacturing

Methods of Manufacturing

The preparation method is to add glacial acetic acid and 2-acetylbenzimidazole to the reaction pot, stir and heat to 80℃, add bromine while stirring under negative pressure, control the reaction temperature at (80±5)℃, and complete the addition. Continue to stir for 1 hour, and then desolvate and react the hydrogen bromide gas generated under reduced pressure for about 1 hour, cool to room temperature, and filter to obtain the product.

Uses

2-(Dibromoacetyl)benzimidazole hydrobromide is an intermediate of the fungicide thiabendazole.

Computed Properties

Molecular Weight:317.96
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:317.88264
Monoisotopic Mass:315.88469
Topological Polar Surface Area:45.8
Heavy Atom Count:14
Complexity:235
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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