TL;DR: Ferrous, tris(5-nitro-1,10-phenanthroline)-, diperchlorate (CAS 15389-73-8) is a chemical compound with molecular formula C36H21Cl2FeN9O14 and molecular weight 928.9934 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
iron(2+);tris(5-nitro-1,10-phenanthroline);diperchlorate
Also Known As: 3C12H7N3O2.2ClO4.Fe, 5292AF, iron(2+);5-nitro-1,10-phenanthroline;diperchlorate, Iron(2+), tris(5-nitro-1,10-phenanthroline-kappaN1,kappaN10)-, diperchlorate, Ferrous, tris(5-nitro-1,10-phenanthroline)-, diperchlorate
| Molecular Formula | C36H21Cl2FeN9O14 |
| Molecular Weight | 928.9934 g/mol |
| XLogP | -1.44 |
| Topological Polar Surface Area (TPSA) | 363.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 0 |
| Exact Mass | 928.9934 Da |
| Heavy Atoms | 62 |
| Complexity | 400.0 |
| SMILES | C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-].C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-].C1=CC2=CC(=C3C=CC=NC3=C2N=C1)[N+](=O)[O-].[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[Fe+2] |
| InChIKey | LIMQGDXKAXYQOJ-UHFFFAOYSA-L |
The XLogP value of -1.44 indicates that Ferrous, tris(5-nitro-1,10-phenanthroline)-, diperchlorate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 363.0 Ų indicates high polarity, suggesting Ferrous, tris(5-nitro-1,10-phenanthroline)-, diperchlorate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ferrous, tris(5-nitro-1,10-phenanthroline)-, diperchlorate has 0 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Ferrous, tris(5-nitro-1,10-phenanthroline)-, diperchlorate is 15389-73-8.
The molecular formula of Ferrous, tris(5-nitro-1,10-phenanthroline)-, diperchlorate is C36H21Cl2FeN9O14.
The molecular weight of Ferrous, tris(5-nitro-1,10-phenanthroline)-, diperchlorate is 928.9934 g/mol.
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