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  • 1-(Phenylsulfonyl)indole-3-boronic acid pinacol ester

  • 1-(Phenylsulfonyl)indole-3-boronic acid pinacol ester

    Catalog Number
    ACM870717934-1
    CAS Number
    870717-93-4
    Product Name
    1-(Phenylsulfonyl)indole-3-boronic acid pinacol ester
    Structure
    Category
    Salt
    IUPAC Name
    1-(benzenesulfonyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole
    Molecular Weight
    383.3g/mol
    Molecular Formula
    C20H22BNO4S
    Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CN(C3=CC=CC=C23)S(=O)(=O)C4=CC=CC=C4
    InChI
    InChI=1S/C20H22BNO4S/c1-19(2)20(3,4)26-21(25-19)17-14-22(18-13-9-8-12-16(17)18)27(23,24)15-10-6-5-7-11-15/h5-14H,1-4H3
    InChI Key
    OMZLHWZHHPAZPW-UHFFFAOYSA-N
    Complexity
    637
    Covalently-Bonded Unit Count
    1
    Exact Mass
    383.136259g/mol
    Formal Charge
    0
    Heavy Atom Count
    27
    Monoisotopic Mass
    383.136259g/mol
    Rotatable Bond Count
    3
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