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  • 1,3,5-Phenyltriboronic acid, tris(pinacol) ester

  • 1,3,5-Phenyltriboronic acid, tris(pinacol) ester

    Catalog Number
    ACM365564052-5
    Product Name
    1,3,5-Phenyltriboronic acid, tris(pinacol) ester
    Structure
    CAS
    365564-05-2
    Category
    Salt
    Synonyms
    1,3,5-Tris(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene
    IUPAC Name
    2-[3,5-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
    Molecular Weight
    456
    Molecular Formula
    C24H39B3O6
    Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)B3OC(C(O3)(C)C)(C)C)B4OC(C(O4)(C)C)(C)C
    InChI
    InChI=1S/C24H39B3O6/c1-19(2)20(3,4)29-25(28-19)16-13-17(26-30-21(5,6)22(7,8)31-26)15-18(14-16)27-32-23(9,10)24(11,12)33-27/h13-15H,1-12H3
    InChI Key
    VKOLBYNBPONPAE-UHFFFAOYSA-N
    Purity
    0.98
    Complexity
    605
    Covalently-Bonded Unit Count
    1
    Exact Mass
    456.302579g/mol
    Formal Charge
    0
    Heavy Atom Count
    33
    Monoisotopic Mass
    456.302579g/mol
    Rotatable Bond Count
    3
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