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  • 1-(3-Cyanopropyl)-3-methylimidazolium bis(trifluoromethylsulfonyl)amide

    • 1-(3-Cyanopropyl)-3-methylimidazolium bis(trifluoromethylsulfonyl)amide

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    Catalog Number
    ACM778593183-1
    CAS Number
    778593-18-3
    Product Name
    1-(3-Cyanopropyl)-3-methylimidazolium bis(trifluoromethylsulfonyl)amide
    Structure
    Category
    Electrolytes
    Synonyms
    1-Methyl-3-(3-cyanopropyl)imidazoliumbis(trifluoromethylsulfonyl)amide
    Description
    Nitrile-functionalized ionic liquid showing superior characteristics in Suzuki and Stille coupling reactions.
    IUPAC Name
    bis(trifluoromethylsulfonyl)azanide;4-(3-methylimidazol-3-ium-1-yl)butanenitrile
    Molecular Weight
    430.35
    Molecular Formula
    C10H12F6N4O4S2
    Canonical SMILES
    C[N+]1=CN(C=C1)CCCC#N.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F
    InChI
    1S/C8H12N3.C2F6NO4S2/c1-10-6-7-11(8-10)5-3-2-4-9;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h6-8H,2-3,5H2,1H3;/q+1;-1
    InChI Key
    NNNHNBMBLGKXSW-UHFFFAOYSA-N
    Melting Point
    75-80 °C (lit.)
    Flash Point
    Not applicable
    Purity
    TaskSpecificIonicLiquid(TSIL),≥98.5%(HPLC/T)
    Appearance
    liquid
    Storage
    −20°C
    Complexity
    532
    Covalently-Bonded Unit Count
    2
    Exact Mass
    430.020416g/mol
    Formal Charge
    0
    Heavy Atom Count
    26
    MDL Number
    MFCD09265194
    Monoisotopic Mass
    430.020416g/mol
    Refractive Index
    n20/D 1.441
    Rotatable Bond Count
    5
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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