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  • 2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine cobalt(II)

  • 2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine cobalt(II)

    Catalog Number
    ACM17632198-2
    CAS Number
    17632-19-8
    Product Name
    2,3,7,8,12,13,17,18-Octaethyl-21H,23H-porphine cobalt(II)
    Structure
    Category
    Other Materials
    Synonyms
    Cobalt(II) 2-3-7-8-12-13-17-18-(octaethyl)porphyrin
    IUPAC Name
    cobalt(2+);2,3,7,8,12,13,17,18-octaethylporphyrin-22,24-diide
    Molecular Weight
    591.7
    Molecular Formula
    C36H44CoN4
    Canonical SMILES
    CCC1=C(C2=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=N5)C=C1[N-]2)CC)CC)CC)CC)C(=C3CC)CC)CC.[Co+2]
    InChI
    InChI=1S/C36H44N4.Co/c1-9-21-22(10-2)30-18-32-25(13-5)26(14-6)34(39-32)20-36-28(16-8)27(15-7)35(40-36)19-33-24(12-4)23(11-3)31(38-33)17-29(21)37-30;/h17-20H,9-16H2,1-8H3;/q-2;+2
    InChI Key
    CILRATIHXSICFS-UHFFFAOYSA-N
    Purity
    99%
    Complexity
    1150
    Covalently-Bonded Unit Count
    2
    Exact Mass
    591.289791
    Formal Charge
    0
    Heavy Atom Count
    41
    Hydrogen Bond Acceptor Count
    4
    Hydrogen Bond Donor Count
    0
    MeSH Entry Terms
    (2,3,7,8,12,13,17,18-octaethyl-21H,23H-porphine)cobalt(II);2,3,7,8,12,13,17,18-octaethyl-21H,23H-porphine cobalt(II);Co(II)OEP;Co(OEP);cobalt(II) 2,3,7,8,12,13,17,18-octaethylporphyrin
    Monoisotopic Mass
    591.289791
    Rotatable Bond Count
    8
    Topological Polar Surface Area
    26.7 Ų
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