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  • 2,3-Pyrazinedicarboxylic Acid

  • 2,3-Pyrazinedicarboxylic Acid

    Catalog Number
    ACM89010
    CAS Number
    89-01-0
    Product Name
    2,3-Pyrazinedicarboxylic Acid
    Structure
    Category
    Metal Organic Frameworks (MOFs); Monomers
    Synonyms
    3-Pyrazinedicarboxylic acid
    IUPAC Name
    Pyrazine-2,3-dicarboxylic acid
    Molecular Weight
    168.11
    Molecular Formula
    C6H4N2O4
    Canonical SMILES
    C1=CN=C(C(=N1)C(=O)O)C(=O)O
    InChI
    InChI=1S/C6H4N2O4/c9-5(10)3-4(6(11)12)8-2-1-7-3/h1-2H,(H,9,10)(H,11,12)
    InChI Key
    ZUCRGHABDDWQPY-UHFFFAOYSA-N
    Boiling Point
    297.01 °C
    Melting Point
    188 °C
    Purity
    95%+
    Density
    1.6328 g/mL at 25 °C(lit.)
    Appearance
    White to Almost white powder to crystal
    Storage
    Store under inert gas
    Complexity
    184
    Covalently-Bonded Unit Count
    1
    EC Number
    201-875-3
    Exact Mass
    168.01710661
    Formal Charge
    0
    Hazard Statements
    H315 : Causes skin irritation.H319 : Causes serious eye irritation.
    Heavy Atom Count
    12
    MDL Number
    MFCD00006131
    MeSH Entry Terms
    2,3-pyrazinedicarboxylic acid
    Monoisotopic Mass
    168.01710661
    NSC Number
    1908
    Precautionary Statements
    P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
    Refractive Index
    n20/D 1.4738(lit.)
    Rotatable Bond Count
    2
    Signal Word
    Warning
    Specific Gravity
    1.16
    Storage Conditions
    Dry place,Room Temperature
    Topological Polar Surface Area
    100 Ų
    UNII
    QNN35WOF29
    XLogP3
    -0.7
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