TL;DR: Docosahexenoic acid (CAS 1704702-50-0) is a chemical compound with molecular formula C22H32O2 and molecular weight 328.24023 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
docosa-2,4,6,8,10,12-hexaenoic acid
Also Known As: Docosahexaenoic acid, docosahexenoic acid, (14C)Docosahexaenoic acid, Docosa-2,4,6,8,10,12-hexaenoic acid, 7-chloro-3-nitro-3,4-dihydro-1H-quinolin-2-one
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C22H32O2 |
| Molecular Weight | 328.24023 g/mol |
| XLogP | 8.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Exact Mass | 328.24023 Da |
| Heavy Atoms | 24 |
| Complexity | 462.0 |
| SMILES | CCCCCCCCCC=CC=CC=CC=CC=CC=CC(=O)O |
| InChIKey | DVSZKTAMJJTWFG-UHFFFAOYSA-N |
The XLogP value of 8.1 indicates that Docosahexenoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Docosahexenoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Docosahexenoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Docosahexenoic acid is 1704702-50-0.
The molecular formula of Docosahexenoic acid is C22H32O2.
The molecular weight of Docosahexenoic acid is 328.24023 g/mol.
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