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  • n-Octyl 4,6-Dibromo-3-fluorothieno[3,4-b]thiophene-2-carboxylate

  • n-Octyl 4,6-Dibromo-3-fluorothieno[3,4-b]thiophene-2-carboxylate

    Catalog Number
    ACM1160823766
    CAS Number
    1160823-76-6
    Product Name
    n-Octyl 4,6-Dibromo-3-fluorothieno[3,4-b]thiophene-2-carboxylate
    Structure
    Category
    Polymers; Semiconductor Blocks
    Synonyms
    4,6-Dibromo-3-fluorothieno[3,4-b]thiophene-2-carboxylic Acid n-Octyl Ester
    IUPAC Name
    octyl 4,6-dibromo-3-fluorothieno[2,3-c]thiophene-2-carboxylate
    Molecular Weight
    472.23
    Molecular Formula
    C15H17Br2FO2S2
    Canonical SMILES
    CCCCCCCCOC(=O)C1=C(C2=C(SC(=C2S1)Br)Br)F
    InChI
    InChI=1S/C15H17Br2FO2S2/c1-2-3-4-5-6-7-8-20-15(19)12-10(18)9-11(21-12)14(17)22-13(9)16/h2-8H2,1H3
    InChI Key
    AXLMQOPQPUEOQD-UHFFFAOYSA-N
    Melting Point
    55 °C
    Purity
    >94.0%(GC)
    Appearance
    Light yellow to Brown to Dark green powder to crystal
    Complexity
    376
    Covalently-Bonded Unit Count
    1
    Exact Mass
    471.90003g/mol
    Formal Charge
    0
    Heavy Atom Count
    22
    MDL Number
    MFCD19940962
    Monoisotopic Mass
    469.90208g/mol
    Rotatable Bond Count
    9
    XLogP3
    8.4
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