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  • 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone

  • 2,3-Dichloro-5,6-dicyano-1,4-benzoquinone

    Catalog Number
    ACM84582
    CAS Number
    84-58-2
    Product Name
    2,3-Dichloro-5,6-dicyano-1,4-benzoquinone
    Structure
    Category
    Charge Transfer Complexes; Molecular Conductors
    IUPAC Name
    4,5-dichloro-3,6-dioxocyclohexa-1,4-diene-1,2-dicarbonitrile
    Molecular Weight
    227g/mol
    Molecular Formula
    C8Cl2N2O2
    Canonical SMILES
    C(#N)C1=C(C(=O)C(=C(C1=O)Cl)Cl)C#N
    InChI
    InChI=1S/C8Cl2N2O2/c9-5-6(10)8(14)4(2-12)3(1-11)7(5)13
    InChI Key
    HZNVUJQVZSTENZ-UHFFFAOYSA-N
    Complexity
    464
    Covalently-Bonded Unit Count
    1
    EC Number
    201-542-2
    Exact Mass
    225.933683g/mol
    Formal Charge
    0
    Heavy Atom Count
    14
    MeSH Entry Terms
    2,3-DDQ;2,3-dichloro-5,6-dicyano-1,4-benzoquinone;2,3-dichloro-5,6-dicyanobenzoquinone;dichlorodicyanobenzoquinone
    Monoisotopic Mass
    225.933683g/mol
    NSC Number
    401087
    Rotatable Bond Count
    0
    UNII
    1H5KD39UH7
    XLogP3
    1.6
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