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  • 4,7-Bis(5-bromo-2-thienyl)-5,6-difluoro-2-(2-hexyldecyl)-2H-benzotriazole

  • 4,7-Bis(5-bromo-2-thienyl)-5,6-difluoro-2-(2-hexyldecyl)-2H-benzotriazole

    Catalog Number
    ACM1887135967
    CAS Number
    1887135-96-7
    Product Name
    4,7-Bis(5-bromo-2-thienyl)-5,6-difluoro-2-(2-hexyldecyl)-2H-benzotriazole
    Category
    Self-Assembly Materials
    IUPAC Name
    4,7-bis(5-bromothiophen-2-yl)-5,6-difluoro-2-(2-hexyldecyl)benzotriazole
    Molecular Weight
    701.6g/mol
    Molecular Formula
    C30H37Br2F2N3S2
    Canonical SMILES
    CCCCCCCCC(CCCCCC)CN1N=C2C(=C(C(=C(C2=N1)C3=CC=C(S3)Br)F)F)C4=CC=C(S4)Br
    InChI
    InChI=1S/C30H37Br2F2N3S2/c1-3-5-7-9-10-12-14-20(13-11-8-6-4-2)19-37-35-29-25(21-15-17-23(31)38-21)27(33)28(34)26(30(29)36-37)22-16-18-24(32)39-22/h15-18,20H,3-14,19H2,1-2H3
    InChI Key
    OGFVBTYFQPBCTH-UHFFFAOYSA-N
    Complexity
    673
    Covalently-Bonded Unit Count
    1
    Exact Mass
    701.07432g/mol
    Formal Charge
    0
    Heavy Atom Count
    39
    Monoisotopic Mass
    699.07637g/mol
    Rotatable Bond Count
    16
    XLogP3
    14
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