TL;DR: acetic acid, fluoro-, aluminum salt (CAS 63905-85-1) is a chemical compound with molecular formula C6H6AlF3O6 and molecular weight 257.9932 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
aluminum tris(2-fluoroacetate)
Also Known As: Aluminum fluoroacetate, aluminum;2-fluoroacetate, aluminum 2-fluoroacetate, aluminum,2-fluoroacetate, Aluminium tris(fluoroacetate)
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H6AlF3O6 |
| Molecular Weight | 257.9932 g/mol |
| XLogP | -4.26 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 0 |
| Exact Mass | 257.9932 Da |
| Heavy Atoms | 16 |
| Complexity | 37.0 |
| SMILES | C(C(=O)[O-])F.C(C(=O)[O-])F.C(C(=O)[O-])F.[Al+3] |
| InChIKey | USQJXTPMMUXTSG-UHFFFAOYSA-K |
The XLogP value of -4.26 indicates that acetic acid, fluoro-, aluminum salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for acetic acid, fluoro-, aluminum salt. Following Lipinski's Rule of Five, acetic acid, fluoro-, aluminum salt has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of acetic acid, fluoro-, aluminum salt is 63905-85-1.
The molecular formula of acetic acid, fluoro-, aluminum salt is C6H6AlF3O6.
The molecular weight of acetic acid, fluoro-, aluminum salt is 257.9932 g/mol.
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