Etiohemin
[CAS# 19413-49-1]

Identification

• Name: Etiohemin
• Synonyms: Etiohemin I; Iron, Chloro(2,7,12,17-Tetraethyl-3,8,13,18-Tetramethyl-21H,23H-Porphinato(2-)-N21,N22,N23,N24)-, (Sp-5-12)-
• Molecular Formula: C₃₂H₃₆ClFeN₄
• Molecular Weight: 567.96
• CAS Registry Number: 19413-49-1
• SMILES: [N-]1C3=C(C(=C1C=C2N=C(C(=C2CC)C)C=C5[N-]C(=CC4=NC(=C3)C(=C4CC)C)C(=C5CC)C)C)CC.[Cl-].[Fe+3]
• InChI: 1S/C32H36N4.ClH.Fe/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;;/h13-16H,9-12H2,1-8H3;1H;/q-2;;+3/p-1
• InChIKey: OZOWYXHSRNQLRW-UHFFFAOYSA-M

Properties

• Boiling point: 797.9°C at 760 mmHg (Cal.)
• Flash point: 341.3°C (Cal.)