ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate
TL;DR: ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate (CAS 135897-92-6) is a chemical compound with molecular formula C12H20O3 and molecular weight 212.14125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate
Also Known As: J2.183.280D, J3.774.407G, ethyl 2,6-dimethyl-8-hydroxy-2(E),6(E)-octadienoate, ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate, ethyl (6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate
Technical Specifications
| Molecular Formula | C12H20O3 |
| Molecular Weight | 212.14125 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 212.14125 Da |
| Heavy Atoms | 15 |
| Complexity | 252.0 |
| SMILES | CCOC(=O)/C(=C/CC/C(=C/CO)/C)/C |
| InChIKey | QLEUMPJBYKHTCE-VTTRTIMMSA-N |
Chemical Property Profile of ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate
Property Insights of ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate. With a topological polar surface area (TPSA) of 46.5 Ų, ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate?
The CAS number of ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate is 135897-92-6.
What is the molecular formula of ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate?
The molecular formula of ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate is C12H20O3.
What is the molecular weight of ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate?
The molecular weight of ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate is 212.14125 g/mol.
Where can I buy ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate?
You can request a quote for ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate?
Yes, CoreyChem provides custom synthesis services for ethyl (2E,6E)-8-hydroxy-2,6-dimethylocta-2,6-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.