7,12-Bis(2,2-Difluoroethenyl)-3,8,13,17-Tetramethyl-21H,23H-Porphine-2,18-Dipropanoic Acid Dimethyl Ester
[CAS# 123279-53-8]

Identification

• Name: 7,12-Bis(2,2-Difluoroethenyl)-3,8,13,17-Tetramethyl-21H,23H-Porphine-2,18-Dipropanoic Acid Dimethyl Ester
• Synonyms: 3(2),3(2),8(2),8(2)-Tetrafluoroprotoporphyrin Dimethyl Ester; 3,8-Fppd; Dimethyl 7,12-Bis(2,2-Difluoroethenyl)-3,8,13,17-Tetramethyl-21H,23H-Porphine-2,18-Dipropanoate
• Molecular Formula: C₃₆H₃₄F₄N₄O₄
• Molecular Weight: 662.68
• CAS Registry Number: 123279-53-8
• SMILES: C(C2=C(C3=CC1=C(C(=C([NH]1)C=C5[NH]C(=CC4=NC(=CC2=N3)C(=C4C)CCC(OC)=O)C(=C5C)C=C(F)F)C=C(F)F)C)C)CC(OC)=O
• InChI: 1S/C36H34F4N4O4/c1-17-21(7-9-35(45)47-5)29-16-30-22(8-10-36(46)48-6)18(2)27(42-30)14-31-24(12-34(39)40)20(4)28(44-31)15-32-23(11-33(37)38)19(3)26(43-32)13-25(17)41-29/h11-16,43-44H,7-10H2,1-6H3
• InChIKey: PPWOXUVBOGBFSQ-UHFFFAOYSA-N

Properties

• Density: 1.294g/cm³ (Cal.)
• Boiling point: 1011.454°C at 760 mmHg (Cal.)
• Flash point: 565.507°C (Cal.)