TL;DR: Palmitoylcholine (CAS 13100-90-8) is a chemical compound with molecular formula C21H44NO2+ and molecular weight 342.33722 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hexadecanoyloxyethyl(trimethyl)azanium
Also Known As: Palmitoylcholine, Ichthycrinotoxin, O-Palmitoylcholine, Palmitylcholin, choline palmitate
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C21H44NO2+ |
| Molecular Weight | 342.33722 g/mol |
| XLogP | 7.5 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 342.33722 Da |
| Heavy Atoms | 24 |
| Complexity | 284.0 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC[N+](C)(C)C |
| InChIKey | ODYPFMHOOQOHEF-UHFFFAOYSA-N |
The XLogP value of 7.5 indicates that Palmitoylcholine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Palmitoylcholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Palmitoylcholine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Palmitoylcholine is 13100-90-8.
The molecular formula of Palmitoylcholine is C21H44NO2+.
The molecular weight of Palmitoylcholine is 342.33722 g/mol.
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