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  • 4-Butoxyphthalonitrile

    • 4-Butoxyphthalonitrile

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    Catalog Number
    ACM81560329-1
    Product Name
    4-Butoxyphthalonitrile
    Structure
    CAS
    81560-32-9
    Category
    Phthalonitriles & Naphthalonitriles
    IUPAC Name
    4-butoxybenzene-1,2-dicarbonitrile
    Molecular Weight
    200.24g/mol
    Molecular Formula
    C12H12N2O
    Canonical SMILES
    CCCCOC1=CC(=C(C=C1)C#N)C#N
    InChI
    InChI=1S/C12H12N2O/c1-2-3-6-15-12-5-4-10(8-13)11(7-12)9-14/h4-5,7H,2-3,6H2,1H3
    InChI Key
    AVGCGXBXMPWLOW-UHFFFAOYSA-N
    Complexity
    283
    Covalently-Bonded Unit Count
    1
    Exact Mass
    200.094963g/mol
    Formal Charge
    0
    Heavy Atom Count
    15
    Monoisotopic Mass
    200.094963g/mol
    Rotatable Bond Count
    4
    XLogP3
    2.6
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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