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  • 9,9-Dihexylfluorene-2,7-diboronic acid bis(1,3-propanediol) ester

  • 9,9-Dihexylfluorene-2,7-diboronic acid bis(1,3-propanediol) ester

    Catalog Number
    ACM250597296-1
    CAS Number
    250597-29-6
    Product Name
    9,9-Dihexylfluorene-2,7-diboronic acid bis(1,3-propanediol) ester
    Structure
    Category
    Salt; Synthetic Tools and Reagents
    IUPAC Name
    2-[7-(1,3,2-dioxaborinan-2-yl)-9,9-dihexylfluoren-2-yl]-1,3,2-dioxaborinane
    Molecular Weight
    502.3g/mol
    Molecular Formula
    C31H44B2O4
    Canonical SMILES
    B1(OCCCO1)C2=CC3=C(C=C2)C4=C(C3(CCCCCC)CCCCCC)C=C(C=C4)B5OCCCO5
    InChI
    InChI=1S/C31H44B2O4/c1-3-5-7-9-17-31(18-10-8-6-4-2)29-23-25(32-34-19-11-20-35-32)13-15-27(29)28-16-14-26(24-30(28)31)33-36-21-12-22-37-33/h13-16,23-24H,3-12,17-22H2,1-2H3
    InChI Key
    SHZXKQJLRLVYGP-UHFFFAOYSA-N
    Complexity
    610
    Covalently-Bonded Unit Count
    1
    Exact Mass
    502.34257g/mol
    Formal Charge
    0
    Heavy Atom Count
    37
    Monoisotopic Mass
    502.34257g/mol
    Rotatable Bond Count
    12
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