TL;DR: Methyl dodeca-2,6-dienoate (CAS 2307909-44-8) is a chemical compound with molecular formula C13H22O2 and molecular weight 210.16199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl dodeca-2,6-dienoate
Also Known As: methyl dodeca-2,6-dienoate, Methyl (2E,6Z)-dodeca-2,6-dienoate, 2,6-Dodecadienoic acid,methyl ester, (E,Z)- (8CI,9CI), CID 119939, D94411
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H22O2 |
| Molecular Weight | 210.16199 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 210.16199 Da |
| Heavy Atoms | 15 |
| Complexity | 205.0 |
| SMILES | CCCCCC=CCCC=CC(=O)OC |
| InChIKey | IYSZVOVZPVKXIJ-UHFFFAOYSA-N |
The XLogP value of 4.2 indicates that Methyl dodeca-2,6-dienoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl dodeca-2,6-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl dodeca-2,6-dienoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Methyl dodeca-2,6-dienoate is 2307909-44-8.
The molecular formula of Methyl dodeca-2,6-dienoate is C13H22O2.
The molecular weight of Methyl dodeca-2,6-dienoate is 210.16199 g/mol.
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