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  • Carboxylic acid MOF ligand-tricarboxylic acid MOF ligand
  • 4,4'-[[2-[(4-carboxyphenoxy)methyl]-2-ethylpropane-1,3-diyl]dioxy]dibenzoic acid

  • 4,4'-[[2-[(4-carboxyphenoxy)methyl]-2-ethylpropane-1,3-diyl]dioxy]dibenzoic acid

    Catalog Number
    ACM1359740230-1
    Product Name
    4,4'-[[2-[(4-carboxyphenoxy)methyl]-2-ethylpropane-1,3-diyl]dioxy]dibenzoic acid
    CAS
    1359740-23-0
    Category
    Carboxylic acid MOF ligand-tricarboxylic acid MOF ligand
    IUPAC Name
    4-[2,2-bis[(4-carboxyphenoxy)methyl]butoxy]benzoic acid
    Molecular Weight
    494.5g/mol
    Molecular Formula
    C27H26O9
    InChI
    InChI=1S/C27H26O9/c1-2-27(15-34-21-9-3-18(4-10-21)24(28)29,16-35-22-11-5-19(6-12-22)25(30)31)17-36-23-13-7-20(8-14-23)26(32)33/h3-14H,2,15-17H2,1H3,(H,28,29)(H,30,31)(H,32,33)
    InChI Key
    JQXNOSZNYSTYCJ-UHFFFAOYSA-N
    Complexity
    622
    Compound Is Canonicalized
    Yes
    Covalently-Bonded Unit Count
    1
    Defined Atom Stereocenter Count
    0
    Defined Bond Stereocenter Count
    0
    Exact Mass
    494.15768240g/mol
    Formal Charge
    0
    Heavy Atom Count
    36
    Hydrogen Bond Acceptor Count
    9
    Hydrogen Bond Donor Count
    3
    Isotope Atom Count
    0
    Monoisotopic Mass
    494.15768240g/mol
    Rotatable Bond Count
    13
    Topological Polar Surface Area
    140Ų
    Undefined Atom Stereocenter Count
    0
    Undefined Bond Stereocenter Count
    0
    XLogP3
    4.8
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