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  • 2,3,7,8,12,13,17,18-Octafluoro-5,10,15,20-tetrakis(pentafluorophenyl)porphyrin

  • 2,3,7,8,12,13,17,18-Octafluoro-5,10,15,20-tetrakis(pentafluorophenyl)porphyrin

    Catalog Number
    ACM121399880-1
    CAS Number
    121399-88-0
    Product Name
    2,3,7,8,12,13,17,18-Octafluoro-5,10,15,20-tetrakis(pentafluorophenyl)porphyrin
    Structure
    Category
    Ligands for Functional Metal Complexes; Phthalocyanine Dyes, Porphyrin Dyes
    Synonyms
    2,3,7,8,12,13,17,18-Octafluoro-5,10,15,20-tetrakis(2,3,4,5,6-pentafluorophenyl)-21,23-dihydroporphyrin
    IUPAC Name
    2,3,7,8,12,13,17,18-octafluoro-5,10,15,20-tetrakis(2,3,4,5,6-pentafluorophenyl)-21,23-dihydroporphyrin
    Molecular Weight
    1118.47
    Molecular Formula
    C44H2F28N4
    Canonical SMILES
    C1(=C2C(=C(C(=C(C3=NC(=C(C4=C(C(=C(N4)C(=C5C(=C(C1=N5)F)F)C6=C(C(=C(C(=C6F)F)F)F)F)F)F)C7=C(C(=C(C(=C7F)F)F)F)F)C(=C3F)F)C8=C(C(=C(C(=C8F)F)F)F)F)N2)F)F)C9=C(C(=C(C(=C9F)F)F)F)F
    InChI
    YPQJLILOZYQHNR-UHFFFAOYSA-N
    InChI Key
    InChI=1S/C44H2F28N4/c45-9-1(10(46)18(54)25(61)17(9)53)5-37-29(65)31(67)39(73-37)6(2-11(47)19(55)26(62)20(56)12(2)48)41-33(69)35(71)43(75-41)8(4-15(51)23(59)28(64)24(60)16(4)52)44-36(72)34(70)42(76-44)7(40-32(68)30(66)38(5)74-40)3-13(49)21(57)27(63)22(58)14(3)50/h73,76H
    Purity
    98%
    Complexity
    1690
    Covalently-Bonded Unit Count
    1
    Exact Mass
    1117.9832346
    Heavy Atom Count
    76
    Hydrogen Bond Acceptor Count
    30
    Hydrogen Bond Donor Count
    2
    Monoisotopic Mass
    1117.9832346
    Rotatable Bond Count
    4
    Topological Polar Surface Area
    57.4 Ų
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