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  • N,N'-Bis(2-ethylhexyloxy)-1,7-dibroMo-3,4,9,10-perylene diiMide

  • N,N'-Bis(2-ethylhexyloxy)-1,7-dibroMo-3,4,9,10-perylene diiMide

    Catalog Number
    ACM851786157
    CAS Number
    851786-15-7
    Product Name
    N,N'-Bis(2-ethylhexyloxy)-1,7-dibroMo-3,4,9,10-perylene diiMide
    Category
    Organic Light-Emitting Diode (OLED) Materials
    IUPAC Name
    11,22-dibromo-7,18-bis(2-ethylhexyl)-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(22),2,4,9,11,13(23),14,16(24),20,25-decaene-6,8,17,19-tetrone
    Molecular Weight
    772.6g/mol
    Molecular Formula
    C40H40Br2N2O4
    Canonical SMILES
    CCCCC(CC)CN1C(=O)C2=C3C(=CC(=C4C3=C(C=C2)C5=C(C=C6C7=C(C=CC4=C57)C(=O)N(C6=O)CC(CC)CCCC)Br)Br)C1=O
    InChI
    InChI=1S/C40H40Br2N2O4/c1-5-9-11-21(7-3)19-43-37(45)25-15-13-23-34-30(42)18-28-32-26(38(46)44(40(28)48)20-22(8-4)12-10-6-2)16-14-24(36(32)34)33-29(41)17-27(39(43)47)31(25)35(23)33/h13-18,21-22H,5-12,19-20H2,1-4H3
    InChI Key
    YGQFUAOYYKZQKI-UHFFFAOYSA-N
    Complexity
    1170
    Covalently-Bonded Unit Count
    1
    Exact Mass
    772.13343g/mol
    Formal Charge
    0
    Heavy Atom Count
    48
    Monoisotopic Mass
    770.13548g/mol
    Rotatable Bond Count
    12
    XLogP3
    11.3
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