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  • 4-(Dicyanomethylene)-2-tert-butyl-6-(1,1,7,7-tetramethyljulolidin-4-yl-vinyl)-4H-pyran

  • 4-(Dicyanomethylene)-2-tert-butyl-6-(1,1,7,7-tetramethyljulolidin-4-yl-vinyl)-4H-pyran

    Catalog Number
    ACM200052706-2
    CAS Number
    200052-70-6
    Product Name
    4-(Dicyanomethylene)-2-tert-butyl-6-(1,1,7,7-tetramethyljulolidin-4-yl-vinyl)-4H-pyran
    Structure
    Category
    Organic Light-Emitting Diode (OLED) Materials; Other Electronic Materials
    IUPAC Name
    2-[2-tert-butyl-6-[(E)-2-(4,4,10,10-tetramethyl-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-7-yl)ethenyl]pyran-4-ylidene]propanedinitrile
    Molecular Weight
    453.6g/mol
    Molecular Formula
    C30H35N3O
    Canonical SMILES
    CC1(CCN2CCC(C3=C2C1=CC(=C3)C=CC4=CC(=C(C#N)C#N)C=C(O4)C(C)(C)C)(C)C)C
    InChI
    InChI=1S/C30H35N3O/c1-28(2,3)26-17-21(22(18-31)19-32)16-23(34-26)9-8-20-14-24-27-25(15-20)30(6,7)11-13-33(27)12-10-29(24,4)5/h8-9,14-17H,10-13H2,1-7H3/b9-8+
    InChI Key
    HXWWMGJBPGRWRS-CMDGGOBGSA-N
    Complexity
    1010
    Covalently-Bonded Unit Count
    1
    Exact Mass
    453.278013g/mol
    Formal Charge
    0
    Heavy Atom Count
    34
    Monoisotopic Mass
    453.278013g/mol
    Rotatable Bond Count
    3
    XLogP3
    7.2
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