8(2),8(2)-Difluoroprotoporphyrin Dimethyl Ester
[CAS# 123279-54-9]

Identification

• Name: 8(2),8(2)-Difluoroprotoporphyrin Dimethyl Ester
• Synonyms: 8-Fppd; Dimethyl 7-(2,2-Difluoroethenyl)-12-Ethenyl-3,8,13,17-Tetramethyl-21H,23H-Porphine-2,18-Dipropanoate; 21H,23H-Porphine-2,18-Dipropanoic Acid, 7-(2,2-Difluoroethenyl)-12-Ethenyl-3,8,13,17-Tetramethyl-, Dimethyl Ester
• Molecular Formula: C₃₆H₃₆F₂N₄O₄
• Molecular Weight: 626.70
• CAS Registry Number: 123279-54-9
• 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)C)C)CC(OC)=O
• InChI: 1S/C36H36F2N4O4/c1-8-22-18(2)26-14-27-19(3)23(9-11-35(43)45-6)31(40-27)17-32-24(10-12-36(44)46-7)20(4)28(41-32)16-33-25(13-34(37)38)21(5)29(42-33)15-30(22)39-26/h8,13-17,39,42H,1,9-12H2,2-7H3
• InChIKey: ANDZQVARVBVOBG-UHFFFAOYSA-N

Properties

• Density: 1.246g/cm³ (Cal.)
• Boiling point: 1018.108°C at 760 mmHg (Cal.)
• Flash point: 569.531°C (Cal.)