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  • 1,3-Benzoxazole-5-boronic acid pinacol ester

  • 1,3-Benzoxazole-5-boronic acid pinacol ester

    Catalog Number
    ACM936902124-1
    CAS Number
    936902-12-4
    Product Name
    1,3-Benzoxazole-5-boronic acid pinacol ester
    Structure
    Category
    Salt
    IUPAC Name
    5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,3-benzoxazole
    Molecular Weight
    245.08g/mol
    Molecular Formula
    C13H16BNO3
    Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)OC=N3
    InChI
    InChI=1S/C13H16BNO3/c1-12(2)13(3,4)18-14(17-12)9-5-6-11-10(7-9)15-8-16-11/h5-8H,1-4H3
    InChI Key
    CHLWHHUKKHNQTH-UHFFFAOYSA-N
    Complexity
    318
    Covalently-Bonded Unit Count
    1
    Exact Mass
    245.122323g/mol
    Formal Charge
    0
    Heavy Atom Count
    18
    Monoisotopic Mass
    245.122323g/mol
    Rotatable Bond Count
    1
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