(1Z,4Z,9Z,15Z)-2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-21,23-dihydroporphyrin
[CAS 69150-58-9]

Identification

• Name: (1Z,4Z,9Z,15Z)-2,7,12,17-tetraethyl-3,8,13,18-tetramethyl-21,23-dihydroporphyrin
• Synonyms: 2,7,12,17-Tetraethyl-3, 8,13, 18-tetramethyl-21H,23H-porphine; 3,8,13,18-Tetraethyl-2,7,12,17-tetramethyl-21H,23H-porphine; aetioporphyrin I
• Molecular Formula: C₃₂H₃₈N₄
• Molecular Weight: 478.67
• CAS Registry Number: 69150-58-9
• SMILES: CC\C2=C(/C)c1cc5nc(cc4nc(cc3nc(cc2n1)c(C)c3CC)C(\C)=C4\CC)c(C)c5CC
• InChI: 1S/C32H38N4/c1-9-21-17(5)25-14-30-23(11-3)19(7)27(35-30)16-32-24(12-4)20(8)28(36-32)15-31-22(10-2)18(6)26(34-31)13-29(21)33-25/h13-16,33,36H,9-12H2,1-8H3/b25-14-,26-13-,27-16-,28-15-,29-13-,30-14-,31-15-,32-16-
• InChIKey: VIXIHEJFGRACDI-GCISPZHASA-N

Properties

• Density: 1.102g/cm³ (Cal.)
• Boiling point: 792.693°C at 760 mmHg (Cal.)
• Flash point: 338.837°C (Cal.)

Safety Data

• Safety Description: IRRITANT

References

• (1): Ana R. M. Soares, Yugaananthy Thanaiah, Masahiko Taniguchi and Jonathan S. Lindsey. Aqueous–membrane partitioning of β-substituted porphyrins encompassing diverse polarity, New J. Chem., 2013, 37, 1087.