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  • 5-(4-CArboxyphenyl)-10,15,20-triphenylporphyrin

  • 5-(4-CArboxyphenyl)-10,15,20-triphenylporphyrin

    Catalog Number
    ACM95051108-1
    CAS Number
    95051-10-8
    Product Name
    5-(4-CArboxyphenyl)-10,15,20-triphenylporphyrin
    Structure
    Category
    Ligands for Functional Metal Complexes; Other Materials; Phthalocyanine Dyes, Porphyrin Dyes
    Synonyms
    5-(4-Carboxyphenyl)-10,15,20-triphenyl-21H,23H-porphine
    Description
    Alfa Chemistry offers 5-(4-Carboxyphenyl)-10,15,20-triphenylporphyrin products for various research purposes. Please contact us by email if you do not find the specification you are looking for on this page.
    IUPAC Name
    4-(10,15,20-triphenyl-21,23-dihydroporphyrin-5-yl)benzoic acid
    Molecular Weight
    658.76
    Molecular Formula
    C45H30N4O2
    Canonical SMILES
    C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=C(C=C8)C(=O)O)C=C4)C9=CC=CC=C9)N3
    InChI
    GZTMFXHPFNRUNU-UHFFFAOYSA-N
    InChI Key
    InChI=1S/C45H30N4O2/c50-45(51)32-18-16-31(17-19-32)44-39-26-24-37(48-39)42(29-12-6-2-7-13-29)35-22-20-33(46-35)41(28-10-4-1-5-11-28)34-21-23-36(47-34)43(30-14-8-3-9-15-30)38-25-27-40(44)49-38/h1-27,46,49H,(H,50,51)
    Melting Point
    >300 °C
    Purity
    >98.0%(HPLC)
    Appearance
    Dark purple powder to crystal
    Application
    The porphyrin metal complexes are important in-vivo, because they are included in chlorophyll functioning photo absorption and photo electron transfer for photosynthesis, and also included in heme transporting oxygen in blood. In addition, porphyrinato metal complexes are useful for photoelectron functional materials, metal complex catalysts and molecular electrical conductors.
    Complexity
    1140
    Covalently-Bonded Unit Count
    1
    Exact Mass
    658.23687621
    Features And Benefits
    Chemical modifications of substituted groups, metal centers, and axial ligands on the porphyrinato metal complexes show various functionalities. Normal porphyrin complexes have sharp absorptions, around 400-500 nm, and the Q band around 500-700 nm which is a relatively weak absorption. Molar absorption coefficients of the Soret band are up to the order of 106 M/cm. The chlorophyll and porphyrinato zinc complexes hardly show energy relaxation of absorbed light, but easily show photoelectron transfer.
    Heavy Atom Count
    51
    Hydrogen Bond Acceptor Count
    4
    Hydrogen Bond Donor Count
    3
    MDL Number
    MFCD01366156
    Monoisotopic Mass
    658.23687621
    Rotatable Bond Count
    5
    Storage Conditions
    Store at room temperature and dry
    Topological Polar Surface Area
    94.7 Ų
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