Hemin
[CAS# 15489-47-1]

Identification

• Name: Hemin
• Synonyms: Zinc03977863
• Molecular Formula: C₃₄H₃₂N₄O₄
• Molecular Weight: 560.65
• CAS Registry Number: 15489-47-1
• SMILES: C(C2=C(C3=CC1=C(C(=C([NH]1)C=C5[NH]C(=CC4=NC(=CC2=N3)C(=C4C)CCC([O-])=O)C(=C5C)C=C)C=C)C)C)CC([O-])=O
• InChI: 1S/C34H34N4O4/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25/h7-8,13-16,35-36H,1-2,9-12H2,3-6H3,(H,39,40)(H,41,42)/p-2
• InChIKey: ZCFFYALKHPIRKJ-UHFFFAOYSA-L

Properties

• Boiling point: 1128.937°C at 760 mmHg (Cal.)
• Flash point: 636.558°C (Cal.)