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CAS 66916-98-1

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2-Bromo-4-methoxybenzeneacetonitrile

Description:
2-Bromo-4-methoxybenzeneacetonitrile, with the CAS number 66916-98-1, is an organic compound characterized by its aromatic structure, which includes a bromine atom and a methoxy group attached to a benzene ring. This compound features a nitrile functional group (-C≡N) linked to an acetic acid derivative, contributing to its reactivity and potential applications in organic synthesis. The presence of the bromine atom enhances its electrophilic character, making it a useful intermediate in various chemical reactions, including nucleophilic substitutions and coupling reactions. The methoxy group serves as an electron-donating substituent, influencing the compound's reactivity and solubility properties. Typically, compounds like this are utilized in the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals. Its physical properties, such as melting point, boiling point, and solubility, can vary based on the specific conditions and purity of the sample. Safety data should be consulted for handling and storage, as with any chemical substance.
Formula:C9H8BrNO
InChI:InChI=1S/C9H8BrNO/c1-12-8-3-2-7(4-5-11)9(10)6-8/h2-3,6H,4H2,1H3
InChI key:InChIKey=HGIMMKGDPPDRTN-UHFFFAOYSA-N
SMILES:C(C#N)C1=C(Br)C=C(OC)C=C1
Synonyms:
  • 2-(2-Bromo-4-methoxyphenyl)acetonitrile
  • Benzeneacetonitrile, 2-bromo-4-methoxy-
  • 2-Bromo-4-methoxybenzeneacetonitrile
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