TL;DR: 11-Methoxy-3,7,11-trimethyldodeca-2,4-dienoic acid (CAS 53092-52-7) is a chemical compound with molecular formula C16H28O3 and molecular weight 268.20386 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
11-methoxy-3,7,11-trimethyldodeca-2,4-dienoic acid
Also Known As: Methoprene acid, METOPRENIC ACID, all-trans-S-Methoprene acid, KBio2_000136, KBio2_002704
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H28O3 |
| Molecular Weight | 268.20386 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 268.20386 Da |
| Heavy Atoms | 19 |
| Complexity | 327.0 |
| SMILES | CC(CCCC(C)(C)OC)CC=CC(=CC(=O)O)C |
| InChIKey | MNYBEULOKRVZKY-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 11-Methoxy-3,7,11-trimethyldodeca-2,4-dienoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 11-Methoxy-3,7,11-trimethyldodeca-2,4-dienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11-Methoxy-3,7,11-trimethyldodeca-2,4-dienoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 11-Methoxy-3,7,11-trimethyldodeca-2,4-dienoic acid is 53092-52-7.
The molecular formula of 11-Methoxy-3,7,11-trimethyldodeca-2,4-dienoic acid is C16H28O3.
The molecular weight of 11-Methoxy-3,7,11-trimethyldodeca-2,4-dienoic acid is 268.20386 g/mol.
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