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  • 4,7-bis(5-bromo-4-(2-ethylhexyl)thiophen-2-yl)-5,6-difluorobenzo[c][1,2,5]thiadiazole

  • 4,7-bis(5-bromo-4-(2-ethylhexyl)thiophen-2-yl)-5,6-difluorobenzo[c][1,2,5]thiadiazole

    Catalog Number
    ACM1293389328
    CAS Number
    1293389-32-8
    Product Name
    4,7-bis(5-bromo-4-(2-ethylhexyl)thiophen-2-yl)-5,6-difluorobenzo[c][1,2,5]thiadiazole
    Category
    Organic Light-Emitting Diode (OLED) Materials
    IUPAC Name
    4,7-bis[5-bromo-4-(2-ethylhexyl)thiophen-2-yl]-5,6-difluoro-2,1,3-benzothiadiazole
    Molecular Weight
    718.6g/mol
    Molecular Formula
    C30H36Br2F2N2S3
    Canonical SMILES
    CCCCC(CC)CC1=C(SC(=C1)C2=C(C(=C(C3=NSN=C23)C4=CC(=C(S4)Br)CC(CC)CCCC)F)F)Br
    InChI
    InChI=1S/C30H36Br2F2N2S3/c1-5-9-11-17(7-3)13-19-15-21(37-29(19)31)23-25(33)26(34)24(28-27(23)35-39-36-28)22-16-20(30(32)38-22)14-18(8-4)12-10-6-2/h15-18H,5-14H2,1-4H3
    InChI Key
    FOYFULWMSKDEJJ-UHFFFAOYSA-N
    Complexity
    684
    Covalently-Bonded Unit Count
    1
    Exact Mass
    718.03549g/mol
    Formal Charge
    0
    Heavy Atom Count
    39
    Monoisotopic Mass
    716.03754g/mol
    Rotatable Bond Count
    14
    XLogP3
    14.2
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