TL;DR: Tris(propylenediamine)tungstatoiron pentahydrate (CAS 80660-42-0) is a chemical compound with molecular formula C9H24FeN6O4W-6 and molecular weight 520.0718 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tris(1-azanidylpropan-2-ylazanide);dioxido(dioxo)tungsten;iron(2+)
Also Known As: Tris(propylenediamine)tungstatoiron pentahydrate, Iron, tris(propylenediamine)tungstato-, pentahydrate, Iron(2+), tris(1,2-propanediamine-N,N')-, (T-4)-tetraoxotungstate(2-) (1:1), pentahydrate, 1-azanidylpropan-2-ylazanide,dioxido(dioxo)tungsten,iron(2+), 1-azanidylpropan-2-ylazanide; dioxido(dioxo)tungsten; iron(2+)
| Molecular Formula | C9H24FeN6O4W-6 |
| Molecular Weight | 520.0718 g/mol |
| XLogP | 1.82 |
| Topological Polar Surface Area (TPSA) | 86.3 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 0 |
| Exact Mass | 520.0718 Da |
| Heavy Atoms | 21 |
| Complexity | 149.0 |
| SMILES | CC(C[NH-])[NH-].CC(C[NH-])[NH-].CC(C[NH-])[NH-].[O-][W](=O)(=O)[O-].[Fe+2] |
| InChIKey | OGSNWGANHFGWFD-UHFFFAOYSA-N |
The XLogP value of 1.82 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tris(propylenediamine)tungstatoiron pentahydrate. The TPSA of 86.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Tris(propylenediamine)tungstatoiron pentahydrate. Following Lipinski's Rule of Five, Tris(propylenediamine)tungstatoiron pentahydrate has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Tris(propylenediamine)tungstatoiron pentahydrate is 80660-42-0.
The molecular formula of Tris(propylenediamine)tungstatoiron pentahydrate is C9H24FeN6O4W-6.
The molecular weight of Tris(propylenediamine)tungstatoiron pentahydrate is 520.0718 g/mol.
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