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  • 3-Cyano-4-methylphenylboronic acid

  • 3-Cyano-4-methylphenylboronic acid

    Catalog Number
    ACMA00015066
    Product Name
    3-Cyano-4-methylphenylboronic acid
    Category
    Salt
    IUPAC Name
    (3-cyano-4-methylphenyl)boronic acid
    Molecular Weight
    160.97g/mol
    Molecular Formula
    C8H8BNO2
    Canonical SMILES
    B(C1=CC(=C(C=C1)C)C#N)(O)O
    InChI
    InChI=1S/C8H8BNO2/c1-6-2-3-8(9(11)12)4-7(6)5-10/h2-4,11-12H,1H3
    InChI Key
    BFFJLRZTXUFIRI-UHFFFAOYSA-N
    Complexity
    199
    Covalently-Bonded Unit Count
    1
    Exact Mass
    161.064809g/mol
    Formal Charge
    0
    Heavy Atom Count
    12
    Monoisotopic Mass
    161.064809g/mol
    Rotatable Bond Count
    1
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