1-Ethoxy-3,7-dimethylocta-2,6-diene
TL;DR: 1-Ethoxy-3,7-dimethylocta-2,6-diene (CAS 22882-89-9) is a chemical compound with molecular formula C12H22O and molecular weight 182.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethoxy-3,7-dimethylocta-2,6-diene
Also Known As: neryl ethyl ether, Ethyl geranyl ether, Geranyl ethyl ether, 1-Ethoxy-3,7-dimethylocta-2,6-diene, 1-Ethoxy-3,7-dimethyl-2,6-octadiene
| Molecular Formula | C12H22O |
|---|---|
| Molecular Weight | 182.17 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 182.16707 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 22882-89-9 |
|---|---|
| SMILES | CCOCC=C(C)CCC=C(C)C |
| InChIKey | LOUIMJFJROISMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Ethoxy-3,7-dimethylocta-2,6-diene (CAS 22882-89-9), with molecular formula C12H22O and molecular weight 182.17 g/mol. IUPAC: 1-ethoxy-3,7-dimethylocta-2,6-diene.
Chemical Property Profile of 1-Ethoxy-3,7-dimethylocta-2,6-diene
Property Insights of 1-Ethoxy-3,7-dimethylocta-2,6-diene
The XLogP value of 3.8 indicates that 1-Ethoxy-3,7-dimethylocta-2,6-diene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-Ethoxy-3,7-dimethylocta-2,6-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethoxy-3,7-dimethylocta-2,6-diene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Ethoxy-3,7-dimethylocta-2,6-diene?
The CAS number of 1-Ethoxy-3,7-dimethylocta-2,6-diene is 22882-89-9.
What is the molecular formula of 1-Ethoxy-3,7-dimethylocta-2,6-diene?
The molecular formula of 1-Ethoxy-3,7-dimethylocta-2,6-diene is C12H22O.
What is the molecular weight of 1-Ethoxy-3,7-dimethylocta-2,6-diene?
The molecular weight of 1-Ethoxy-3,7-dimethylocta-2,6-diene is 182.17 g/mol.
Where can I buy 1-Ethoxy-3,7-dimethylocta-2,6-diene?
You can request a quote for 1-Ethoxy-3,7-dimethylocta-2,6-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethoxy-3,7-dimethylocta-2,6-diene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethoxy-3,7-dimethylocta-2,6-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.