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  • 2,5-Bis(2-hexyldecyl)-3,6-di(2-thienyl)pyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione, 95%

  • 2,5-Bis(2-hexyldecyl)-3,6-di(2-thienyl)pyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione, 95%

    Catalog Number
    ACM1044598802
    CAS Number
    1044598-80-2
    Product Name
    2,5-Bis(2-hexyldecyl)-3,6-di(2-thienyl)pyrrolo[3,4-c]pyrrole-1,4(2H,5H)-dione, 95%
    Category
    Organic Light-Emitting Diode (OLED) Materials
    IUPAC Name
    2,5-bis(2-hexyldecyl)-1,4-dithiophen-2-ylpyrrolo[3,4-c]pyrrole-3,6-dione
    Molecular Weight
    749.2g/mol
    Molecular Formula
    C46H72N2O2S2
    Canonical SMILES
    CCCCCCCCC(CCCCCC)CN1C(=C2C(=C(N(C2=O)CC(CCCCCC)CCCCCCCC)C3=CC=CS3)C1=O)C4=CC=CS4
    InChI
    InChI=1S/C46H72N2O2S2/c1-5-9-13-17-19-23-29-37(27-21-15-11-7-3)35-47-43(39-31-25-33-51-39)41-42(45(47)49)44(40-32-26-34-52-40)48(46(41)50)36-38(28-22-16-12-8-4)30-24-20-18-14-10-6-2/h25-26,31-34,37-38H,5-24,27-30,35-36H2,1-4H3
    InChI Key
    ILGXCBVXJXFCGR-UHFFFAOYSA-N
    Complexity
    1030
    Covalently-Bonded Unit Count
    1
    Exact Mass
    748.503522g/mol
    Formal Charge
    0
    Heavy Atom Count
    52
    Monoisotopic Mass
    748.503522g/mol
    Rotatable Bond Count
    30
    XLogP3
    16.5
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