7,12-Diethenyl-3,8,13,17-tetramethyl-21-phenyl-21H,23H-porphine-2,18-dipropanoic acid
[CAS# 80367-89-1]

Identification

• Name: 7,12-Diethenyl-3,8,13,17-tetramethyl-21-phenyl-21H,23H-porphine-2,18-dipropanoic acid
• Synonyms: N-Phenylprotoporphyrin Ix
• Molecular Formula: C₄₀H₃₈N₄O₄
• Molecular Weight: 638.76
• CAS Registry Number: 80367-89-1
• SMILES: [N]2(C3=CC5=NC(=CC1=C(C(=C([NH]1)C=C4N=C(C=C2C(=C3CCC(=O)O)C)C(=C4C)C=C)C=C)C)C(=C5CCC(=O)O)C)C6=CC=CC=C6
• InChI: 1S/C40H38N4O4/c1-7-27-22(3)31-18-32-24(5)29(14-16-39(45)46)36(43-32)21-38-30(15-17-40(47)48)25(6)37(44(38)26-12-10-9-11-13-26)20-35-28(8-2)23(4)33(42-35)19-34(27)41-31/h7-13,18-21,41H,1-2,14-17H2,3-6H3,(H,45,46)(H,47,48)
• InChIKey: DBKSOCPRBDIFRO-UHFFFAOYSA-N

Properties

• Density: 1.246g/cm³ (Cal.)