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  • 2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-di-n-octylfluorene

  • 2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-di-n-octylfluorene

    Catalog Number
    ACM196207586-2
    CAS Number
    196207-58-6
    Product Name
    2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-di-n-octylfluorene
    Category
    Organic Light-Emitting Diode (OLED) Materials; Polymers
    Synonyms
    9,9-Di-n-octylfluorene-2,7-diboronic Acid Bis(pinacol) Ester
    IUPAC Name
    2-[9,9-dioctyl-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluoren-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
    Molecular Weight
    642.58000000000004
    Molecular Formula
    C41H64B2O4
    Canonical SMILES
    B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)C4=C(C3(CCCCCCCC)CCCCCCCC)C=C(C=C4)B5OC(C(O5)(C)C)(C)C
    InChI
    InChI=1S/C41H64B2O4/c1-11-13-15-17-19-21-27-41(28-22-20-18-16-14-12-2)35-29-31(42-44-37(3,4)38(5,6)45-42)23-25-33(35)34-26-24-32(30-36(34)41)43-46-39(7,8)40(9,10)47-43/h23-26,29-30H,11-22,27-28H2,1-10H3
    InChI Key
    FAHIZHKRQQNPLC-UHFFFAOYSA-N
    Melting Point
    129 °C
    Purity
    >98.0%(HPLC)
    Appearance
    White to Almost white powder to crystal
    Application
    The purpose of 2,7-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9,9-di-n-octylfluorene is to serve as a versatile building block in the synthesis of advanced materials for electronic applications. This compound, a fluorene derivative, is utilized in creating organic semiconducting materials, which are integral to the development of technologies such as OLEDs (Organic Light Emitting Diodes), PLEDs (Polymer Light Emitting Diodes), OFETs (Organic Field-Effect Transistors), and polymer solar cells. Its role is particularly significant in the preparation of specific nonfullerene electron acceptors used in high-performance organic solar cells, contributing to the advancement of renewable energy solutions.
    Complexity
    884
    Covalently-Bonded Unit Count
    1
    Exact Mass
    642.499071g/mol
    Formal Charge
    0
    Heavy Atom Count
    47
    Monoisotopic Mass
    642.499071g/mol
    Rotatable Bond Count
    16
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