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  • 4,4'-(Acetylene-1,2-diyl)bis(phenylboronic acid pinacol ester)

  • 4,4'-(Acetylene-1,2-diyl)bis(phenylboronic acid pinacol ester)

    Catalog Number
    ACM849681647-1
    CAS Number
    849681-64-7
    Product Name
    4,4'-(Acetylene-1,2-diyl)bis(phenylboronic acid pinacol ester)
    Structure
    Category
    Salt
    IUPAC Name
    4,4,5,5-tetramethyl-2-[4-[2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethynyl]phenyl]-1,3,2-dioxaborolane
    Molecular Weight
    430.2g/mol
    Molecular Formula
    C26H32B2O4
    Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)B4OC(C(O4)(C)C)(C)C
    InChI
    InChI=1S/C26H32B2O4/c1-23(2)24(3,4)30-27(29-23)21-15-11-19(12-16-21)9-10-20-13-17-22(18-14-20)28-31-25(5,6)26(7,8)32-28/h11-18H,1-8H3
    InChI Key
    QJTLCFKOLMALPJ-UHFFFAOYSA-N
    Complexity
    654
    Covalently-Bonded Unit Count
    1
    Exact Mass
    430.24867g/mol
    Formal Charge
    0
    Heavy Atom Count
    32
    Monoisotopic Mass
    430.24867g/mol
    Rotatable Bond Count
    4
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