Pyridine Hemochrome
[CAS# 15629-11-5]

Identification

• Name: Pyridine Hemochrome
• Synonyms: Protohemochrome; Pyridine Hemochrome; Pyridine Hemochromogen
• Molecular Formula: C₄₄H₄₂FeN₆O₄
• Molecular Weight: 774.70
• CAS Registry Number: 15629-11-5
• SMILES: [N-]4C5=CC1=C(C(=C([N-]1)C=C2N=C(C(=C2C)C=C)C=C3N=C(C(=C3C)C=C)C=C4C(=C5CCC([O-])=O)C)C)CCC([O-])=O.[H+].[H+].C6=NC=CC=C6.C7=NC=CC=C7.[Fe++]
• InChI: 1S/C34H34N4O4.2C5H5N.Fe/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;2*1-2-4-6-5-3-1;/h7-8,13-16H,1-2,9-12H2,3-6H3,(H4,35,36,37,38,39,40,41,42);2*1-5H;/q;;;+2/p-2
• InChIKey: OHYSXOGLNDQNRD-UHFFFAOYSA-L

Properties

• Boiling point: 1128.5°C at 760 mmHg (Cal.)
• Flash point: 636.3°C (Cal.)