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  • 2,4-Pyridinedicarboxylic acid hydrate

  • 2,4-Pyridinedicarboxylic acid hydrate

    Catalog Number
    ACM499809
    CAS Number
    499-80-9
    Product Name
    2,4-Pyridinedicarboxylic acid hydrate
    Structure
    Category
    Monomers
    IUPAC Name
    pyridine-2,4-dicarboxylic acid
    Molecular Weight
    167.12g/mol
    Molecular Formula
    C7H5NO4
    Canonical SMILES
    C1=CN=C(C=C1C(=O)O)C(=O)O
    InChI
    InChI=1S/C7H5NO4/c9-6(10)4-1-2-8-5(3-4)7(11)12/h1-3H,(H,9,10)(H,11,12)
    InChI Key
    MJIVRKPEXXHNJT-UHFFFAOYSA-N
    Melting Point
    249.0 °C
    Purity
    N/A
    Solubility
    0.01 M
    Complexity
    204
    Covalently-Bonded Unit Count
    1
    EC Number
    207-892-2
    Exact Mass
    167.021858g/mol
    Formal Charge
    0
    Heavy Atom Count
    12
    MeSH Entry Terms
    2,4-PDCA;2,4-PDCX;2,4-pyridinedicarboxylic acid;pyridine-2,4-dicarboxylic acid
    Monoisotopic Mass
    167.021858g/mol
    NSC Number
    403248
    Rotatable Bond Count
    2
    UNII
    AFI29F0TVL
    XLogP3
    0.2
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