12-Ethenyl-3,8,13,17-Tetramethyl-21H,23H-Porphine-2,7,18-Tripropanoic Acid
[CAS# 30783-27-8]

Identification

• Name: 12-Ethenyl-3,8,13,17-Tetramethyl-21H,23H-Porphine-2,7,18-Tripropanoic Acid
• Synonyms: Harderoporphyrin
• Molecular Formula: C₃₅H₃₆N₄O₆
• Molecular Weight: 608.69
• CAS Registry Number: 30783-27-8
• SMILES: C(C3=C(C4=CC5=NC(=CC1=C(C(=C([NH]1)C=C2N=C(C(=C2C)CCC(=O)O)C=C3[NH]4)C)C=C)C(=C5CCC(=O)O)C)C)CC(=O)O
• InChI: 1S/C35H36N4O6/c1-6-21-17(2)25-13-26-18(3)23(8-11-34(42)43)31(37-26)16-32-24(9-12-35(44)45)20(5)28(39-32)15-30-22(7-10-33(40)41)19(4)27(38-30)14-29(21)36-25/h6,13-16,36,39H,1,7-12H2,2-5H3,(H,40,41)(H,42,43)(H,44,45)
• InChIKey: KECOXFKVIHSIBO-UHFFFAOYSA-N

Properties

• Density: 1.32g/cm³ (Cal.)
• Boiling point: 1191.198°C at 760 mmHg (Cal.)
• Flash point: 674.212°C (Cal.)