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4-(2-Bromoacetyl)benzonitrile

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4-(2-Bromoacetyl)benzonitrile Basic information

Product Name:
4-(2-Bromoacetyl)benzonitrile
Synonyms:
  • 4-(2-BROMOACETYL)BENZONITRILE
  • 4-CYANOPHENACYL BROMIDE
  • 4-(BROMOACETYL)BENZONITRILE
  • 2-BROMO-4'-CYANOACETOPHENONE
  • BUTTPARK 41\03-55
  • cyanophenacylbromide
  • p-Bromoacetylbenzonitrile
  • 4-Cyanophenacyl bromide 97%
CAS:
20099-89-2
MF:
C9H6BrNO
MW:
224.05
EINECS:
606-435-8
Product Categories:
  • intermediates
  • C8 to C9
  • Cyanides/Nitriles
  • Nitrogen Compounds
Mol File:
20099-89-2.mol
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4-(2-Bromoacetyl)benzonitrile Chemical Properties

Melting point:
92-96 °C(lit.)
Boiling point:
342.4±22.0 °C(Predicted)
Density 
1.56±0.1 g/cm3(Predicted)
storage temp. 
under inert gas (nitrogen or Argon) at 2-8°C
solubility 
soluble in Methanol
form 
Crystalline Powder
color 
Off-white to light yellow
BRN 
2087648
InChIKey
LJANCPRIUMHGJE-UHFFFAOYSA-N
CAS DataBase Reference
20099-89-2(CAS DataBase Reference)
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Safety Information

Hazard Codes 
C
Risk Statements 
20/21/22-34
Safety Statements 
26-27-36/37/39-45
RIDADR 
UN 2928 6.1/PG 2
WGK Germany 
3
Hazard Note 
Corrosive
HazardClass 
6.1
PackingGroup 
II
HS Code 
29269090

MSDS

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4-(2-Bromoacetyl)benzonitrile Usage And Synthesis

Odor

Irritating

Chemical Properties

off-white to light yellow crystalline powder

Uses

2-Bromo-4′-cyanoacetophenone may be used to synthesize:

  • 3-acylindolizines
  • (2R,3R)-3-[4-(4-cyanophenyl)thiazol-2-yl]-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)-2-butanol
  • 1-[2-(4-cyanophenyl)-2-oxoethyl]-1,10-phenanthrolinium bromide

Uses

4-(2-Bromoacetyl)benzonitrile is useful for the irreversible inhibitory activity of Glycogen synthase kinase 3 (GSK-3). Phenylhalomethylketones can be used in the study of novel GSK-3 inhibitors.

General Description

2-Bromo-4′-cyanoacetophenone can be synthesized from ethylbenzene via aerobic photooxidation using aqueous HBr.

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