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  • Hexaphthalic acid

    • Hexaphthalic acid

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    Catalog Number
    ACM1246015462-1
    Product Name
    Hexaphthalic acid
    CAS
    1246015-46-2
    Category
    Carboxylic acid MOF ligand-dicarboxylic acid MOF ligand
    Synonyms
    [1,1':4',1'':4'',1''':4''',1'''':4'''',1'''''-Sexiphenyl]-4,4'''''-dicarboxylic acid
    IUPAC Name
    4-[4-[4-[4-[4-(4-carboxyphenyl)phenyl]phenyl]phenyl]phenyl]benzoic acid
    Molecular Weight
    546.61
    Molecular Formula
    C38H26O4
    InChI
    InChI=1S/C38H26O4/c39-37(40)35-21-17-33(18-22-35)31-13-9-29(10-14-31)27-5-1-25(2-6-27)26-3-7-28(8-4-26)30-11-15-32(16-12-30)34-19-23-36(24-20-34)38(41)42/h1-24H,(H,39,40)(H,41,42)
    InChI Key
    WZYFHDBTDJEEAC-UHFFFAOYSA-N
    Purity
    95%
    Complexity
    780
    Compound Is Canonicalized
    Yes
    Covalently-Bonded Unit Count
    1
    Defined Atom Stereocenter Count
    0
    Defined Bond Stereocenter Count
    0
    Exact Mass
    546.18310931g/mol
    Formal Charge
    0
    Heavy Atom Count
    42
    Hydrogen Bond Acceptor Count
    4
    Hydrogen Bond Donor Count
    2
    Isotope Atom Count
    0
    Monoisotopic Mass
    546.18310931g/mol
    Rotatable Bond Count
    7
    Stability
    [1,1':4',1'':4'',1''':4''',1'''':4'''',1'''''-Sexiphenyl ]-4,4'''''-dicarboxylic acidLogged in to view
    Topological Polar Surface Area
    74.6Ų
    Undefined Atom Stereocenter Count
    0
    Undefined Bond Stereocenter Count
    0
    XLogP3
    9.1
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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