3-[7,12,17-Tris-(2-Carboxy-Ethyl)-3,8,13,18-Tetrakis-Carboxymethyl-22,24-Dihydro-Porphin-2-Yl]-Propionic Acid
[CAS# 607-14-7]

Identification

• Name: 3-[7,12,17-Tris-(2-Carboxy-Ethyl)-3,8,13,18-Tetrakis-Carboxymethyl-22,24-Dihydro-Porphin-2-Yl]-Propionic Acid
• Synonyms: 3,8,13,18-Tetrakis(Carboxymethyl)Porphyrin-2,7,12,17-Tetrapropionic Acid; Chebi:27484; C05767
• Molecular Formula: C₄₀H₃₈N₄O₁₆
• Molecular Weight: 830.76
• CAS Registry Number: 607-14-7
• SMILES: C(CC(=O)O)C1=C(CC(=O)O)C2=CC5=NC(=CC4=C(C(=C(C=C3[NH]C(=CC1=N2)C(=C3CCC(=O)O)CC(=O)O)[NH]4)CC(=O)O)CCC(=O)O)C(=C5CCC(=O)O)CC(=O)O
• InChI: 1S/C40H38N4O16/c45-33(46)5-1-17-21(9-37(53)54)29-14-26-19(3-7-35(49)50)23(11-39(57)58)31(43-26)16-28-20(4-8-36(51)52)24(12-40(59)60)32(44-28)15-27-18(2-6-34(47)48)22(10-38(55)56)30(42-27)13-25(17)41-29/h13-16,41-42H,1-12H2,(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)
• InChIKey: MOTVYDVWODTRDF-UHFFFAOYSA-N

Properties

• Density: 1.58g/cm³ (Cal.)
• Boiling point: 1542.598°C at 760 mmHg (Cal.)
• Flash point: 886.731°C (Cal.)