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  • 2-Nitro-4-(trifluoromethyl)benzonitrile

  • 2-Nitro-4-(trifluoromethyl)benzonitrile

    Catalog Number
    ACM778949
    Product Name
    2-Nitro-4-(trifluoromethyl)benzonitrile
    Structure
    CAS
    778-94-9
    Category
    CVD Precursors
    IUPAC Name
    2-nitro-4-(trifluoromethyl)benzonitrile
    Molecular Weight
    216.12g/mol
    Molecular Formula
    C8H3F3N2O2
    Canonical SMILES
    C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])C#N
    InChI
    InChI=1S/C8H3F3N2O2/c9-8(10,11)6-2-1-5(4-12)7(3-6)13(14)15/h1-3H
    InChI Key
    BQCWLXXZTCLGSZ-UHFFFAOYSA-N
    Complexity
    301
    Covalently-Bonded Unit Count
    1
    EC Number
    212-298-1
    Exact Mass
    216.014662g/mol
    Formal Charge
    0
    Heavy Atom Count
    15
    Monoisotopic Mass
    216.014662g/mol
    NSC Number
    88323
    Rotatable Bond Count
    0
    UNII
    E6Z0MKD079
    XLogP3
    1.9
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