3-Ethoxy-1,1,5-trimethylcyclohexane
TL;DR: 3-Ethoxy-1,1,5-trimethylcyclohexane (CAS 67583-77-1) is a chemical compound with molecular formula C11H22O and molecular weight 170.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxy-1,1,5-trimethylcyclohexane
Also Known As: 3-Ethoxy-1,1,5-trimethylcyclohexane, (Z)-herbal cyclohexane, 3,3,5-Trimethylcyclohexyl ethyl ether, Cyclohexane, 3-ethoxy-1,1,5-trimethyl-, Ethyl 3,3,5-trimethylcyclohexyl ether
| Molecular Formula | C11H22O |
|---|---|
| Molecular Weight | 170.17 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.16707 |
| Heavy Atoms | 12 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 67583-77-1 |
|---|---|
| SMILES | CCOC1CC(CC(C1)(C)C)C |
| InChIKey | JVBNHJDWWBSWLE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Ethoxy-1,1,5-trimethylcyclohexane (CAS 67583-77-1), with molecular formula C11H22O and molecular weight 170.17 g/mol. IUPAC: 3-ethoxy-1,1,5-trimethylcyclohexane.
Chemical Property Profile of 3-Ethoxy-1,1,5-trimethylcyclohexane
Property Insights of 3-Ethoxy-1,1,5-trimethylcyclohexane
The XLogP value of 3.5 indicates that 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, 3-Ethoxy-1,1,5-trimethylcyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 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
Frequently Asked Questions
What is the CAS number of 3-Ethoxy-1,1,5-trimethylcyclohexane?
The CAS number of 3-Ethoxy-1,1,5-trimethylcyclohexane is 67583-77-1.
What is the molecular formula of 3-Ethoxy-1,1,5-trimethylcyclohexane?
The molecular formula of 3-Ethoxy-1,1,5-trimethylcyclohexane is C11H22O.
What is the molecular weight of 3-Ethoxy-1,1,5-trimethylcyclohexane?
The molecular weight of 3-Ethoxy-1,1,5-trimethylcyclohexane is 170.17 g/mol.
Where can I buy 3-Ethoxy-1,1,5-trimethylcyclohexane?
You can request a quote for 3-Ethoxy-1,1,5-trimethylcyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethoxy-1,1,5-trimethylcyclohexane?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethoxy-1,1,5-trimethylcyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.