Octacarboxylate iron-tetrahydroporphyrin

Base Information

• Chemical Name: Octacarboxylate iron-tetrahydroporphyrin
• CAS No.: 52553-42-1
• Molecular Formula: C42H36 Fe N4 O16 . 8 H
• Molecular Weight: 909.62
• Wikipedia: Siroheme
• Mol file: 52553-42-1.mol

Synonyms:octacarboxylate iron-tetrahydroporphyrin;sirohaem;siroheme

Chemical Property of Octacarboxylate iron-tetrahydroporphyrin

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1280°Cat760mmHg
• Flash Point: 727.9°C
• PSA: 326.64000
• Density: g/cm³
• LogP: 2.14060
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 20
• Rotatable Bond Count: 12
• Exact Mass: 916.210167
• Heavy Atom Count: 63
• Complexity: 1690

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [H+].[H+].[H+].[H+].[H+].[H+].[H+].[H+].CC1(C(C2=NC1=CC3=NC(=CC4=C(C(=C([N-]4)C=C5C(=C(C(=C2)[N-]5)CC(=O)[O-])CCC(=O)[O-])CCC(=O)[O-])CC(=O)[O-])C(C3CCC(=O)[O-])(C)CC(=O)[O-])CCC(=O)[O-])CC(=O)[O-].[Fe+2]