Methyl 7,17-Bis(2-Methoxy-2-Oxoethyl)-3,8,12,13,18-Pentakis(3-Methoxy-3-Oxopropyl)-2-Porphyrincarboxylate
[CAS# 531-42-0]

Identification

• Name: Methyl 7,17-Bis(2-Methoxy-2-Oxoethyl)-3,8,12,13,18-Pentakis(3-Methoxy-3-Oxopropyl)-2-Porphyrincarboxylate
• Molecular Formula: C₄₈H₅₄N₄O₁₆
• Molecular Weight: 942.96
• CAS Registry Number: 531-42-0
• SMILES: O=C(OC)CCC\1=C(\c3nc/1cc5nc(cc\2nc(/C(=C/2CC(=O)OC)CCC(=O)OC)cc4c(c(c(c3)n4)CCC(=O)OC)CCC(=O)OC)c(c5C(=O)OC)CCC(=O)OC)CC(=O)OC
• InChI: 1S/C48H54N4O16/c1-61-40(53)14-9-25-26(10-15-41(54)62-2)33-22-37-31(20-46(59)67-7)28(12-17-43(56)64-4)35(51-37)24-39-47(48(60)68-8)29(13-18-44(57)65-5)36(52-39)23-38-30(19-45(58)66-6)27(11-16-42(55)63-3)34(50-38)21-32(25)49-33/h21-24,49,52H,9-20H2,1-8H3/b32-21-,33-22-,34-21-,35-24-,36-23-,37-22-,38-23-,39-24-
• InChIKey: JXFYRPWVBHUVFB-BGKHBZPASA-N

Properties

• Density: 1.291g/cm³ (Cal.)
• Boiling point: 1155.454°C at 760 mmHg (Cal.)
• Flash point: 652.595°C (Cal.)