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CAS 51333-64-3

:

1-(4-Bromo-1H-pyrrol-2-yl)ethanone

Description:
1-(4-Bromo-1H-pyrrol-2-yl)ethanone, with the CAS number 51333-64-3, is an organic compound characterized by its pyrrole ring structure substituted with a bromine atom and an ethanone functional group. This compound typically exhibits a molecular formula that reflects its heterocyclic nature, incorporating both carbon and nitrogen atoms. The presence of the bromine atom introduces notable electrophilic properties, which can influence its reactivity in various chemical reactions, such as nucleophilic substitutions or coupling reactions. The ethanone moiety contributes to its potential as a reactive intermediate in organic synthesis. Additionally, the compound may display specific physical properties, such as solubility in organic solvents and a distinct melting or boiling point, which are influenced by its molecular structure. Its applications may span across pharmaceuticals, agrochemicals, or materials science, depending on the functional groups and reactivity patterns it possesses. As with many brominated compounds, considerations regarding safety and environmental impact are essential due to the potential for bioaccumulation and toxicity.
Formula:C6H6BrNO
InChI:InChI=1S/C6H6BrNO/c1-4(9)6-2-5(7)3-8-6/h2-3,8H,1H3
InChI key:InChIKey=KVEMOSATIHPLAM-UHFFFAOYSA-N
SMILES:C(C)(=O)C1=CC(Br)=CN1
Synonyms:
  • Ketone, 4-bromopyrrol-2-yl methyl
  • 1-(4-Bromo-1H-pyrrol-2-yl)ethanone
  • 1-(4-Bromo-1H-pyrrol-2-yl)ethan-1-one
  • Ethanone, 1-(4-bromo-1H-pyrrol-2-yl)-
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