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  • Carboxylic acid MOF ligand-polycarboxylic acid MOFs ligand
  • 4',4''',4'''''-(1,3,5-triazine-2,4,6-triyl)tris(([1,1'-biphenyl]-4-carboxylic acid))

  • 4',4''',4'''''-(1,3,5-triazine-2,4,6-triyl)tris(([1,1'-biphenyl]-4-carboxylic acid))

    Catalog Number
    ACM1331756627-1
    Product Name
    4',4''',4'''''-(1,3,5-triazine-2,4,6-triyl)tris(([1,1'-biphenyl]-4-carboxylic acid))
    CAS
    1331756-62-7
    Category
    Carboxylic acid MOF ligand-polycarboxylic acid MOFs ligand
    IUPAC Name
    4-[4-[4,6-bis[4-(4-carboxyphenyl)phenyl]-1,3,5-triazin-2-yl]phenyl]benzoic acid
    Molecular Weight
    669.7g/mol
    Molecular Formula
    C42H27N3O6
    InChI
    InChI=1S/C42H27N3O6/c46-40(47)34-19-7-28(8-20-34)25-1-13-31(14-2-25)37-43-38(32-15-3-26(4-16-32)29-9-21-35(22-10-29)41(48)49)45-39(44-37)33-17-5-27(6-18-33)30-11-23-36(24-12-30)42(50)51/h1-24H,(H,46,47)(H,48,49)(H,50,51)
    InChI Key
    WCKARIXPDNMKGB-UHFFFAOYSA-N
    Complexity
    996
    Compound Is Canonicalized
    Yes
    Covalently-Bonded Unit Count
    1
    Defined Atom Stereocenter Count
    0
    Defined Bond Stereocenter Count
    0
    Exact Mass
    669.18998559g/mol
    Formal Charge
    0
    Heavy Atom Count
    51
    Hydrogen Bond Acceptor Count
    9
    Hydrogen Bond Donor Count
    3
    Isotope Atom Count
    0
    Monoisotopic Mass
    669.18998559g/mol
    Rotatable Bond Count
    9
    SSA
    700-800 m2/g
    Topological Polar Surface Area
    151Ų
    Undefined Atom Stereocenter Count
    0
    Undefined Bond Stereocenter Count
    0
    XLogP3
    8.4
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