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  • 4,4'-Biphenyldiboronic acid bis(neopentyl) ester

    • 4,4'-Biphenyldiboronic acid bis(neopentyl) ester

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    Catalog Number
    ACM5487934-2
    Product Name
    4,4'-Biphenyldiboronic acid bis(neopentyl) ester
    Structure
    CAS
    5487-93-4
    Category
    Salt
    Synonyms
    4,4'-Bis-(5,5-dimethyl-[1,3,2]dioxaborinane-2-yl)-biphenyl
    IUPAC Name
    2-[4-[4-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)phenyl]phenyl]-5,5-dimethyl-1,3,2-dioxaborinane
    Molecular Weight
    378.1g/mol
    Molecular Formula
    C22H28B2O4
    Canonical SMILES
    CC1(C)COB(OC1)c2ccc(cc2)-c3ccc(cc3)B4OCC(C)(C)CO4
    InChI
    1S/C22H28B2O4/c1-21(2)13-25-23(26-14-21)19-9-5-17(6-10-19)18-7-11-20(12-8-18)24-27-15-22(3,4)16-28-24/h5-12H,13-16H2,1-4H3
    InChI Key
    NJXUWONHNYJPMY-UHFFFAOYSA-N
    Melting Point
    241-245 °C
    Storage
    room temp
    Complexity
    445
    Covalently-Bonded Unit Count
    1
    Exact Mass
    378.21737g/mol
    Formal Charge
    0
    Heavy Atom Count
    28
    MDL Number
    MFCD01318103
    Monoisotopic Mass
    378.21737g/mol
    Packaging
    1 g in glass bottle
    Rotatable Bond Count
    3
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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