TL;DR: Bismuth(3+) neodecanoate (CAS 34364-26-6) is a chemical compound with molecular formula C30H57BiO6 and molecular weight 722.39594 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bismuth tris(3,3,5,5-tetramethylhexanoate)
Also Known As: Bismuth neodecanoate, Bismuth(3+) neodecanoate, Bismuth(III) neodecanoate, bismuth;3,3,5,5-tetramethylhexanoate, 1-Pentadecanamine, N-pentadecyl-
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C30H57BiO6 |
| Molecular Weight | 722.39594 g/mol |
| XLogP | 4.39 |
| Topological Polar Surface Area (TPSA) | 120.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 722.39594 Da |
| Heavy Atoms | 37 |
| Complexity | 158.0 |
| SMILES | CC(C)(C)CC(C)(C)CC(=O)[O-].CC(C)(C)CC(C)(C)CC(=O)[O-].CC(C)(C)CC(C)(C)CC(=O)[O-].[Bi+3] |
| InChIKey | FNYKAWJEEWSNEH-UHFFFAOYSA-K |
The XLogP value of 4.39 indicates that Bismuth(3+) neodecanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bismuth(3+) neodecanoate. Following Lipinski's Rule of Five, Bismuth(3+) neodecanoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Bismuth(3+) neodecanoate is 34364-26-6.
The molecular formula of Bismuth(3+) neodecanoate is C30H57BiO6.
The molecular weight of Bismuth(3+) neodecanoate is 722.39594 g/mol.
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