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539392 Sigma-Aldrich

2-Bromo-4′-cyanoacetophenone

96%

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Properties

Related Categories Building Blocks, C8 to C9, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds - Organic Building Blocks,
Quality Level   100
assay   96%
mp   92-96 °C (lit.)
SMILES string   BrCC(=O)c1ccc(cc1)C#N
InChI   1S/C9H6BrNO/c10-5-9(12)8-3-1-7(6-11)2-4-8/h1-4H,5H2
InChI key   LJANCPRIUMHGJE-UHFFFAOYSA-N

Description

General description

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

Application

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

Packaging

5, 25 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
Signal word 
Danger
Hazard statements 
RIDADR 
UN 2928 8(6.1) / PGII
WGK Germany 
WGK 3
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable

Documents

Certificate of Analysis (COA)

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Meet Synthia - Retrosynthesis Sofware
Protocols & Articles
Peer-Reviewed Papers
15

References

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