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CAS 269411-71-4

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3-Amino-5-methoxybenzonitrile

Description:
3-Amino-5-methoxybenzonitrile is an organic compound characterized by the presence of an amino group (-NH2), a methoxy group (-OCH3), and a nitrile group (-CN) attached to a benzene ring. The amino group contributes to its basicity and potential for forming hydrogen bonds, while the methoxy group can influence its solubility and reactivity due to its electron-donating properties. The nitrile group, known for its triple bond between carbon and nitrogen, imparts unique chemical reactivity, making the compound useful in various synthetic applications. This compound typically appears as a solid at room temperature and is soluble in polar organic solvents. Its structure allows for potential applications in pharmaceuticals, agrochemicals, and as an intermediate in organic synthesis. Additionally, the presence of both electron-donating and electron-withdrawing groups can affect its electronic properties, making it a subject of interest in studies related to molecular interactions and reactivity patterns. Safety data should be consulted for handling and storage, as with all chemical substances.
Formula:C8H8N2O
InChI:InChI=1S/C8H8N2O/c1-11-8-3-6(5-9)2-7(10)4-8/h2-4H,10H2,1H3
InChI key:InChIKey=FFTOQOKMASMDFH-UHFFFAOYSA-N
SMILES:C(#N)C1=CC(OC)=CC(N)=C1
Synonyms:
  • 3-Amino-5-methoxybenzonitrile
  • 3-Cyano-5-methoxyaniline
  • Benzonitrile, 3-amino-5-methoxy-
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