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  • Thieno[3,2-b]thiophene-2-carbonitrile

  • Thieno[3,2-b]thiophene-2-carbonitrile

    Catalog Number
    ACM40985588
    CAS Number
    40985-58-8
    Product Name
    Thieno[3,2-b]thiophene-2-carbonitrile
    Category
    Small Molecule Semiconductor Building Blocks; Semiconductor Blocks
    IUPAC Name
    thieno[3,2-b]thiophene-5-carbonitrile
    Molecular Weight
    165.2g/mol
    Molecular Formula
    C7H3NS2
    Canonical SMILES
    C1=CSC2=C1SC(=C2)C#N
    InChI
    InChI=1S/C7H3NS2/c8-4-5-3-7-6(10-5)1-2-9-7/h1-3H
    InChI Key
    UPRBPGCXCNBTQH-UHFFFAOYSA-N
    Application
    Thieno[3,2-b]thiophene-2-carbonitrile serves as an essential intermediate in the synthesis of small molecules and polymers, particularly applied in the domain of organic electronics. Its unique structural attributes, characterized by electron-rich fused thiophenes with rigid frameworks and extended π-conjugation, make it an ideal component for modulating the band gap in organic polymer semiconducting materials. This compound finds notable applications in the development of organic field-effect transistors (OFETs) and as interface layers in organic photovoltaic devices (OPVs), functioning as either hole transport layers (HTL) or electron transport layers (ETL).
    Complexity
    183
    Covalently-Bonded Unit Count
    1
    Exact Mass
    164.970691g/mol
    Formal Charge
    0
    Heavy Atom Count
    10
    Monoisotopic Mass
    164.970691g/mol
    Rotatable Bond Count
    0
    XLogP3
    2.8
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