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CAS 3336-40-1

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3,5-Diiodo-4-methoxybenzonitrile

Description:
3,5-Diiodo-4-methoxybenzonitrile is an organic compound characterized by its aromatic structure, which includes a benzene ring substituted with two iodine atoms at the 3 and 5 positions, a methoxy group (-OCH3) at the 4 position, and a nitrile group (-CN) attached to the benzene ring. This compound is typically a solid at room temperature and may exhibit a pale yellow to brown color. Its molecular structure contributes to its unique chemical properties, including potential reactivity due to the presence of the nitrile and iodine substituents, which can influence its behavior in various chemical reactions. The iodine atoms can enhance the compound's electrophilicity, making it useful in synthetic organic chemistry, particularly in coupling reactions or as a precursor for further functionalization. Additionally, the methoxy group can provide solubility in organic solvents and influence the compound's electronic properties. Overall, 3,5-Diiodo-4-methoxybenzonitrile is of interest in research and applications involving pharmaceuticals, agrochemicals, and materials science.
Formula:C8H5I2NO
InChI:InChI=1S/C8H5I2NO/c1-12-8-6(9)2-5(4-11)3-7(8)10/h2-3H,1H3
InChI key:InChIKey=LDZMXYUHLHAQAY-UHFFFAOYSA-N
SMILES:O(C)C1=C(I)C=C(C#N)C=C1I
Synonyms:
  • Methyl ioxynil
  • 3,5-Diiodo-4-methoxybenzonitrile
  • Benzonitrile, 3,5-diiodo-4-methoxy-
  • p-Anisonitrile, 3,5-diiodo-
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