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CAS 144649-99-0

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5-Bromo-2-methoxybenzonitrile

Description:
5-Bromo-2-methoxybenzonitrile is an organic compound characterized by its aromatic structure, which includes a bromine atom and a methoxy group attached to a benzene ring, along with a nitrile functional group. The presence of the bromine atom contributes to its reactivity, making it useful in various chemical syntheses, particularly in the development of pharmaceuticals and agrochemicals. The methoxy group enhances its solubility in organic solvents and can influence its electronic properties, affecting how the compound interacts with other molecules. The nitrile group introduces a polar functional group, which can participate in hydrogen bonding and affect the compound's overall polarity. This compound is typically a solid at room temperature and may exhibit moderate to high stability under standard conditions. Its synthesis often involves bromination and subsequent reactions to introduce the methoxy and nitrile groups. As with many halogenated compounds, it is essential to handle 5-Bromo-2-methoxybenzonitrile with care due to potential toxicity and environmental impact.
Formula:C8H6BrNO
InChI:InChI=1S/C8H6BrNO/c1-11-8-3-2-7(9)4-6(8)5-10/h2-4H,1H3
InChI key:InChIKey=LOASAXVECBZCRJ-UHFFFAOYSA-N
SMILES:O(C)C1=C(C#N)C=C(Br)C=C1
Synonyms:
  • 4-Bromo-2-cyanoanisole
  • 5-Bromo-2-(methyloxy)benzonitrile
  • 5-Bromo-2-Methoxybenzonitrile, 98.0%(Gc)
  • 5-Bromo-o-anisyl cyanide
  • Benzonitrile, 5-bromo-2-methoxy-
  • 5-Bromo-2-methoxybenzonitrile
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