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  • 5,10,15,20-Tetraphenyl-21H,23H-porphine

  • 5,10,15,20-Tetraphenyl-21H,23H-porphine

    Catalog Number
    ACM917237-3
    CAS Number
    917-23-7
    Product Name
    5,10,15,20-Tetraphenyl-21H,23H-porphine
    Structure
    Category
    Other Materials
    IUPAC Name
    5,10,15,20-tetraphenyl-21,23-dihydroporphyrin
    Molecular Weight
    614.7g/mol
    Molecular Formula
    C44H30N4
    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=CC=C8)C=C4)C9=CC=CC=C9)N3
    InChI
    InChI=1S/C44H30N4/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36/h1-28,45,48H
    InChI Key
    YNHJECZULSZAQK-UHFFFAOYSA-N
    Complexity
    851
    Covalently-Bonded Unit Count
    1
    EC Number
    213-025-9
    Exact Mass
    614.247047g/mol
    Formal Charge
    0
    Heavy Atom Count
    48
    Monoisotopic Mass
    614.247047g/mol
    NSC Number
    640184;18506
    Rotatable Bond Count
    4
    XLogP3
    10.4
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