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  • 4,4',4''-(1H-imidazole-2,4,5-triyl)tribenzoic acid

    • 4,4',4''-(1H-imidazole-2,4,5-triyl)tribenzoic acid

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    Catalog Number
    ACM2329408060-2
    Product Name
    4,4',4''-(1H-imidazole-2,4,5-triyl)tribenzoic acid
    CAS
    2329408-06-0
    Category
    Carboxylic acid MOF ligand-tricarboxylic acid MOF ligand
    Synonyms
    H3ITTC
    IUPAC Name
    4-[2,4-bis(4-carboxyphenyl)-1H-imidazol-5-yl]benzoic acid
    Molecular Weight
    428.39
    Molecular Formula
    C24H16N2O6
    InChI
    InChI=1S/C24H16N2O6/c27-22(28)16-7-1-13(2-8-16)19-20(14-3-9-17(10-4-14)23(29)30)26-21(25-19)15-5-11-18(12-6-15)24(31)32/h1-12H,(H,25,26)(H,27,28)(H,29,30)(H,31,32)
    InChI Key
    BNXLCYIDQOYKLW-UHFFFAOYSA-N
    Purity
    95%
    Appearance
    Pale yellow solid
    Complexity
    691
    Compound Is Canonicalized
    Yes
    Covalently-Bonded Unit Count
    1
    Defined Atom Stereocenter Count
    0
    Defined Bond Stereocenter Count
    0
    Exact Mass
    428.10083623g/mol
    Formal Charge
    0
    Heavy Atom Count
    32
    Hydrogen Bond Acceptor Count
    7
    Hydrogen Bond Donor Count
    4
    Isotope Atom Count
    0
    Monoisotopic Mass
    428.10083623g/mol
    Rotatable Bond Count
    6
    Topological Polar Surface Area
    141Ų
    Undefined Atom Stereocenter Count
    0
    Undefined Bond Stereocenter Count
    0
    XLogP3
    3.6
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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