AC1L9KO9 structure

AC1L9KO9

methyl 4-[10,15,20-tris(4-methoxycarbonylphenyl)-21,22,23,24-tetrahydroporphyrin-5-yl]benzoate

Also Known As: MESO-TETRA(4-CARBOXYPHENYL)PORPHINE TETRAMETHYL ESTER|methyl 4-[10,15,20-tris(4-methoxycarbonylphenyl)-21,22,23,24-tetrahydroporphyrin-5-yl]benzoate

CAS: 22112-83-0
Molecular Formula C52H40N4O8
Molecular Weight 848.2846 g/mol
LogP 10.2
Topological Polar Surface Area 161.0 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 10
Rotatable Bonds 12
Exact Mass 848.2846
Monoisotopic Mass 848.2846
Heavy Atoms 64
Complexity 1650.0

Chemical Identifiers

CAS Number 22112-83-0
SMILES COC(=O)C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=C(C6=CC=C2N6)C7=CC=C(C=C7)C(=O)OC)N5)C8=CC=C(C=C8)C(=O)OC)C9=CC=C(C=C9)C(=O)OC)N3
InChIKey UFPMFHXBVJJJHS-UHFFFAOYSA-N

Product Overview

AC1L9KO9 (CAS 22112-83-0), with molecular formula C52H40N4O8 and molecular weight 848.2846 g/mol. IUPAC: methyl 4-[10,15,20-tris(4-methoxycarbonylphenyl)-21,22,23,24-tetrahydroporphyrin-5-yl]benzoate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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