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  • 4,4',4''-Nitrilotribenzoic acid

    • 4,4',4''-Nitrilotribenzoic acid

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    Catalog Number
    ACM118996386-3
    Product Name
    4,4',4''-Nitrilotribenzoic acid
    Structure
    CAS
    118996-38-6
    Category
    Carboxylic acid MOF ligand-tricarboxylic acid MOF ligand
    Synonyms
    H3TCA
    IUPAC Name
    4-(4-carboxy-N-(4-carboxyphenyl)anilino)benzoic acid
    Molecular Weight
    377.35
    Molecular Formula
    C21H15NO6
    InChI
    InChI=1S/C21H15NO6/c23-19(24)13-1-7-16(8-2-13)22(17-9-3-14(4-10-17)20(25)26)18-11-5-15(6-12-18)21(27)28/h1-12H,(H,23,24)(H,25,26)(H,27,28)
    InChI Key
    VEBUOOBGPZWCFE-UHFFFAOYSA-N
    Purity
    98%
    Appearance
    Yellow solid
    Complexity
    489
    Compound Is Canonicalized
    Yes
    Covalently-Bonded Unit Count
    1
    Defined Atom Stereocenter Count
    0
    Defined Bond Stereocenter Count
    0
    Exact Mass
    377.08993720g/mol
    Formal Charge
    0
    Heavy Atom Count
    28
    Hydrogen Bond Acceptor Count
    7
    Hydrogen Bond Donor Count
    3
    Isotope Atom Count
    0
    Monoisotopic Mass
    377.08993720g/mol
    Rotatable Bond Count
    6
    Topological Polar Surface Area
    115Ų
    Undefined Atom Stereocenter Count
    0
    Undefined Bond Stereocenter Count
    0
    XLogP3
    3.7
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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