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2-(2-BROMOACETYL)BENZONITRILE

2-(2-BROMOACETYL)BENZONITRILE structure

2-(2-BROMOACETYL)BENZONITRILE 

structure
  • CAS No:

    683274-86-4

  • Formula:

    C9H6BrNO

  • Chemical Name:

    2-(2-BROMOACETYL)BENZONITRILE

  • Synonyms:

    2-(2-BROMOACETYL)BENZONITRILE;2-(2-Bromoacetyl)benzonitirle;Bromoacetylbenzonitrile;2-(Bromoacetyl)benzonitrile;SCHEMBL392810;CTK2F2550;2-(2-bromo-acetyl)-benzonitrile;DTXSID80618743;ZINC2513555;2-(2-bromoacetyl)benzenecarbonitrile

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

2-(2-BROMOACETYL)BENZONITRILE Basic Attributes

224.05

222.963272

DTXSID80618743

2926909090

Characteristics

40.9

2.1

1.6±0.1 g/cm3

156.2±22.3 °C

1.590

Safety Information

3439

6.1

Computed Properties

Molecular Weight:224.05
XLogP3:2.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:222.96328
Monoisotopic Mass:222.96328
Topological Polar Surface Area:40.9
Heavy Atom Count:12
Complexity:218
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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