(3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane
TL;DR: (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane (CAS 24691-17-6) is a chemical compound with molecular formula C11H22O and molecular weight 170.16707 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trans-(3R,5S)-3-ethoxy-1,1,5-trimethylcyclohexane
Also Known As: (3r,5s)-3-ethoxy-1,1,5-trimethylcyclohexane, 3,3,5-Trimethylcyclohexyl ethyl ether, trans-3-Ethoxy-1,1,5-trimethylcyclohexane, KST-1A3167, 3alpha-Ethoxy-1,1,5beta-trimethylcyclohexane
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H22O |
| Molecular Weight | 170.16707 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.16707 Da |
| Heavy Atoms | 12 |
| Complexity | 140.0 |
| SMILES | CCO[C@@H]1C[C@H](CC(C1)(C)C)C |
| InChIKey | JVBNHJDWWBSWLE-NXEZZACHSA-N |
Chemical Property Profile of (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane
Property Insights of (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane
The XLogP value of 3.5 indicates that (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane 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
What is the CAS number of (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane?
The CAS number of (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane is 24691-17-6.
What is the molecular formula of (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane?
The molecular formula of (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane is C11H22O.
What is the molecular weight of (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane?
The molecular weight of (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane is 170.16707 g/mol.
Where can I buy (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane?
You can request a quote for (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane?
Yes, CoreyChem provides custom synthesis services for (3r,5s)-3-Ethoxy-1,1,5-trimethylcyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.