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CAS 913835-33-3

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(3-cyano-5-nitro-phenyl)boronic acid

Description:
(3-Cyano-5-nitro-phenyl)boronic acid is an organoboron compound characterized by the presence of a boronic acid functional group attached to a phenyl ring that also contains cyano and nitro substituents. This compound typically exhibits a white to off-white crystalline appearance. The boronic acid group (-B(OH)2) is known for its ability to form reversible covalent bonds with diols, making it valuable in various applications, including organic synthesis and medicinal chemistry. The cyano group (-CN) contributes to the compound's electronic properties, potentially enhancing its reactivity and solubility in polar solvents. The nitro group (-NO2) is an electron-withdrawing substituent that can influence the compound's acidity and reactivity. Overall, (3-cyano-5-nitro-phenyl)boronic acid is utilized in cross-coupling reactions, particularly in the synthesis of complex organic molecules, and may also have potential applications in drug development due to its unique structural features. Safety data should be consulted for handling and storage, as with all chemical substances.
Formula:C7H5BN2O4
InChI:InChI=1/C7H5BN2O4/c9-4-5-1-6(8(11)12)3-7(2-5)10(13)14/h1-3,11-12H
SMILES:c1c(cc(cc1B(O)O)N(=O)=O)C#N
Synonyms:
  • 3-Cyano-5-nitrophenylboronic acid
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