TL;DR: Nickel,4-pentanedionato)- (CAS 14024-81-8) is a chemical compound with molecular formula C10H20NiO6 and molecular weight 294.06134 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
nickel;bis(pentane-2,4-dione);dihydrate
Also Known As: Nickel,4-pentanedionato)-, Bis(acetylacetonato)diaquanickel, Diaquabis(acetylacetonato)nickel, Nickel,4-pentanedionato-O,O')-, Nickel bis(acetylacetonate)hydrate
| Molecular Formula | C10H20NiO6 |
| Molecular Weight | 294.06134 g/mol |
| XLogP | -0.5429 |
| Topological Polar Surface Area (TPSA) | 70.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 294.06134 Da |
| Heavy Atoms | 17 |
| Complexity | 199.0 |
| SMILES | CC(=O)CC(=O)C.CC(=O)CC(=O)C.O.O.[Ni] |
| InChIKey | NNNKICBWKSHTDE-UHFFFAOYSA-N |
The XLogP value of -0.5429 indicates that Nickel,4-pentanedionato)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 70.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Nickel,4-pentanedionato)-. Following Lipinski's Rule of Five, Nickel,4-pentanedionato)- has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Nickel,4-pentanedionato)- is 14024-81-8.
The molecular formula of Nickel,4-pentanedionato)- is C10H20NiO6.
The molecular weight of Nickel,4-pentanedionato)- is 294.06134 g/mol.
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