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  • Dibenzo{[f,f']-4,4',7,7'-tetraphenyl}diindeno[1,2,3-cd:1',2',3'-lm]perylene

  • Dibenzo{[f,f']-4,4',7,7'-tetraphenyl}diindeno[1,2,3-cd:1',2',3'-lm]perylene

    Catalog Number
    ACM187086379-1
    CAS Number
    187086-37-9
    Product Name
    Dibenzo{[f,f']-4,4',7,7'-tetraphenyl}diindeno[1,2,3-cd:1',2',3'-lm]perylene
    Category
    Organic Light-Emitting Diode (OLED) Materials
    IUPAC Name
    7,14,25,32-tetraphenylundecacyclo[21.13.2.22,5.03,19.04,16.06,15.08,13.020,37.024,33.026,31.034,38]tetraconta-1,3,5,7,9,11,13,15,17,19,21,23,25,27,29,31,33,35,37,39-icosaene
    Molecular Weight
    805g/mol
    Molecular Formula
    C64H36
    Canonical SMILES
    C1=CC=C(C=C1)C2=C3C=CC=CC3=C(C4=C5C=CC6=C7C=CC8=C9C(=C1C=CC=CC1=C(C9=C1C8=C7C(=C3C6=C5C(=C24)C=C3)C=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1
    InChI
    InChI=1S/C64H36/c1-5-17-37(18-6-1)53-41-25-13-14-26-42(41)54(38-19-7-2-8-20-38)62-50-34-30-46-48-32-36-52-60-51(35-31-47(58(48)60)45-29-33-49(61(53)62)59(50)57(45)46)63-55(39-21-9-3-10-22-39)43-27-15-16-28-44(43)56(64(52)63)40-23-11-4-12-24-40/h1-36H
    InChI Key
    WPPDXAHGCGPUPK-UHFFFAOYSA-N
    Complexity
    2580
    Covalently-Bonded Unit Count
    1
    Exact Mass
    804.281701g/mol
    Formal Charge
    0
    Heavy Atom Count
    64
    Monoisotopic Mass
    804.281701g/mol
    Rotatable Bond Count
    4
    XLogP3
    8.6
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