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CAS 90004-94-7

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1-(4-Bromo-2-nitrophenyl)ethanone

Description:
1-(4-Bromo-2-nitrophenyl)ethanone, with the CAS number 90004-94-7, is an organic compound characterized by its functional groups and structural features. It contains a bromine atom and a nitro group attached to a phenyl ring, which contributes to its reactivity and potential applications in organic synthesis. The ethanone moiety indicates the presence of a ketone functional group, which is known for its ability to undergo various chemical reactions, including nucleophilic additions and reductions. This compound is typically used in the synthesis of more complex organic molecules and may serve as an intermediate in the production of pharmaceuticals or agrochemicals. Its physical properties, such as solubility and melting point, can vary based on the specific conditions and purity of the sample. Additionally, the presence of bromine and nitro groups may impart unique electronic properties, influencing its behavior in chemical reactions. Safety precautions should be observed when handling this compound, as it may pose health risks due to its halogenated and nitro-substituted nature.
Formula:C8H6BrNO3
InChI:InChI=1S/C8H6BrNO3/c1-5(11)7-3-2-6(9)4-8(7)10(12)13/h2-4H,1H3
InChI key:InChIKey=NZUHVXSDFZFAFX-UHFFFAOYSA-N
SMILES:C(C)(=O)C1=C(N(=O)=O)C=C(Br)C=C1
Synonyms:
  • 1-(4-Bromo-2-nitrophenyl)ethan-1-one
  • 4′-Bromo-2′-nitroacetophenone
  • Acetophenone, 4′-bromo-2′-nitro-
  • Ethanone, 1-(4-Bromo-2-Nitrophenyl)-
  • 1-(4-Bromo-2-nitrophenyl)ethanone
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