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  • Porphyrin-A4-porphyrin
  • Meso-Tetra(4-carboxyphenyl)porphine

    • Meso-Tetra(4-carboxyphenyl)porphine

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    Catalog Number
    ACM14609542-1
    Product Name
    Meso-Tetra(4-carboxyphenyl)porphine
    Structure
    CAS
    14609-54-2
    Category
    Porphyrin-A4-porphyrin
    Synonyms
    4,4',4'',4'''-(21H,23H-porphine-5,10,15,20-tetrayl)tetrakis-benzoicacid
    IUPAC Name
    4-[10,15,20-tris(4-carboxyphenyl)-21,23-dihydroporphyrin-5-yl]benzoicacid
    Molecular Weight
    790.77
    Molecular Formula
    C48H30N4O8
    Canonical SMILES
    C1=CC(=CC=C1C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(=O)O)C8=CC=C(C=C8)C(=O)O)C=C4)C9=CC=C(C=C9)C(=O)O)N3)C(=O)O
    InChI
    InChI=1S/C48H30N4O8/c53-45(54)29-9-1-25(2-10-29)41-33-17-19-35(49-33)42(26-3-11-30(12-4-26)46(55)56)37-21-23-39(51-37)44(28-7-15-32(16-8-28)48(59)60)40-24-22-38(52-40)43(36-20-18-34(41)50-36)27-5-13-31(14-6-27)47(57)58/h1-24,49,52H,(H,53,54)(H,55,56)(H,57,58)(H,59,60)
    InChI Key
    HHDUMDVQUCBCEY-UHFFFAOYSA-N
    Melting Point
    >300 °C
    Purity
    97%
    Density
    1.462 ± 0.06 g/ml
    Solubility
    In water, 2.87X10-10 mg/L at 25 °C (est)
    Appearance
    Purple solid
    Storage
    Room temperature
    Color/Form
    Dark blue to purple to black powder
    Complexity
    1310
    Compound Is Canonicalized
    Yes
    Covalently-Bonded Unit Count
    1
    Defined Atom Stereocenter Count
    0
    Defined Bond Stereocenter Count
    0
    Exact Mass
    790.20636393g/mol
    Formal Charge
    0
    Heavy Atom Count
    60
    Hydrogen Bond Acceptor Count
    10
    Hydrogen Bond Donor Count
    6
    Isotope Atom Count
    0
    Log P
    log Kow = 10.97 (est)
    MeSH Entry Terms
    meso-tetra-(4-carboxyphenyl)porphine;TCPP;tetracarboxyphenylporphine
    Monoisotopic Mass
    790.20636393g/mol
    Other Experimental
    Potent photosensitizers ... activated by visible light /Porphyrins/;Henry's Law constant = 7.15X10-43 atm-cu m/mol at 25 °C (est)
    Refractive Index
    Index of refraction: 1.734
    Rotatable Bond Count
    8
    Stability
    Stable under recommended storage conditions.
    Surface Tension
    79.9 dyne/cm
    Topological Polar Surface Area
    207Ų
    Undefined Atom Stereocenter Count
    0
    Undefined Bond Stereocenter Count
    0
    UNII
    E9892W6IMC
    Vapor Pressure
    3.37 mm Hg at 25 °C (est)
    XLogP3
    8.5
    MSDS
    Download MSDS
    COA
    Download COA
    Spec Sheet
    Download Spec Sheet
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