TL;DR: (OC-6-22)-Amminepentakis(cyano-kappaC)ferrate(3-) (CAS 13717-31-2) is a chemical compound with molecular formula C5H3FeN6-3 and molecular weight 202.97685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azane;iron(2+);pentacyanide
Also Known As: pentacyanide, Amminepentacyanoferrate(III), Amminepentacyanoferrate(III) ion, amminepentacyanoferrate(3-), azane;iron(2+);pentacyanide
| Molecular Formula | C5H3FeN6-3 |
| Molecular Weight | 202.97685 g/mol |
| XLogP | 0.64135 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 0 |
| Exact Mass | 202.97685 Da |
| Heavy Atoms | 12 |
| Complexity | 10.0 |
| SMILES | [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.N.[Fe+2] |
| InChIKey | QBOFWNFBPMXYTO-UHFFFAOYSA-N |
The XLogP value of 0.64135 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (OC-6-22)-Amminepentakis(cyano-kappaC)ferrate(3-). The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (OC-6-22)-Amminepentakis(cyano-kappaC)ferrate(3-). Following Lipinski's Rule of Five, (OC-6-22)-Amminepentakis(cyano-kappaC)ferrate(3-) has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of (OC-6-22)-Amminepentakis(cyano-kappaC)ferrate(3-) is 13717-31-2.
The molecular formula of (OC-6-22)-Amminepentakis(cyano-kappaC)ferrate(3-) is C5H3FeN6-3.
The molecular weight of (OC-6-22)-Amminepentakis(cyano-kappaC)ferrate(3-) is 202.97685 g/mol.
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