3,1-Meso-Tetrakis(2-Hexanamidophenyl)Porphyrin
[CAS# 68561-01-3]

Identification

• Name: 3,1-Meso-Tetrakis(2-Hexanamidophenyl)Porphyrin
• Synonyms: Hexanamide, N,N',N'',N'''-(21H,23H-Porphine-5,10,15,20-Tetrayltetra-2,1-Phenylene)Tetrakis-, Stereoisomer; 3,1-Mthpp
• Molecular Formula: C₆₈H₇₄N₈O₄
• Molecular Weight: 1067.38
• CAS Registry Number: 68561-01-3
• SMILES: C9=C(C1=C8[NH]C(=C(C6=NC(=C(C4=NC(=C(C2=CC=C1[NH]2)C3=CC=CC=C3NC(=O)CCCCC)C=C4)C5=CC=CC=C5NC(=O)CCCCC)C=C6)C7=CC=CC=C7NC(=O)CCCCC)C=C8)C(=CC=C9)NC(=O)CCCCC
• InChI: 1S/C68H74N8O4/c1-5-9-13-33-61(77)73-49-29-21-17-25-45(49)65-53-37-39-55(69-53)66(46-26-18-22-30-50(46)74-62(78)34-14-10-6-2)57-41-43-59(71-57)68(48-28-20-24-32-52(48)76-64(80)36-16-12-8-4)60-44-42-58(72-60)67(56-40-38-54(65)70-56)47-27-19-23-31-51(47)75-63(79)35-15-11-7-3/h17-32,37-44,69-70H,5-16,33-36H2,1-4H3,(H,73,77)(H,74,78)(H,75,79)(H,76,80)
• InChIKey: DFSCMZVKRSMTKP-UHFFFAOYSA-N

Properties

• Density: 1.204g/cm³ (Cal.)