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  • 4-Cyano-2-methylphenylboronic acid

  • 4-Cyano-2-methylphenylboronic acid

    Catalog Number
    ACM313546188
    CAS Number
    313546-18-8
    Product Name
    4-Cyano-2-methylphenylboronic acid
    Structure
    Category
    Salt
    IUPAC Name
    (4-cyano-2-methylphenyl)boronic acid
    Molecular Weight
    160.97g/mol
    Molecular Formula
    C8H8BNO2
    Canonical SMILES
    B(C1=C(C=C(C=C1)C#N)C)(O)O
    InChI
    InChI=1S/C8H8BNO2/c1-6-4-7(5-10)2-3-8(6)9(11)12/h2-4,11-12H,1H3
    InChI Key
    RGCVYEOTYJCNOS-UHFFFAOYSA-N
    Purity
    95%
    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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