1-Tert-butyl-4-methoxycyclohexane
TL;DR: 1-Tert-butyl-4-methoxycyclohexane (CAS 74052-93-0) 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.
1-tert-butyl-4-methoxycyclohexane
Also Known As: 1-tert-butyl-4-methoxycyclohexane, 1-Methoxy-4-tert-butylcyclohexane, 4-tert-butylcyclohexyl methyl ether, cis-4-t-Butylcyclohexyl methyl ether, 1beta-Methoxy-4beta-tert-butylcyclohexane
| Molecular Formula | C11H22O |
|---|---|
| Molecular Weight | 170.17 g/mol |
| LogP | 3.6 |
| 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 | 126.0 |
Chemical Identifiers
| CAS Number | 74052-93-0 |
|---|---|
| SMILES | CC(C)(C)C1CCC(CC1)OC |
| InChIKey | XMLDPBGRPWQRBE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Tert-butyl-4-methoxycyclohexane (CAS 74052-93-0), with molecular formula C11H22O and molecular weight 170.17 g/mol. IUPAC: 1-tert-butyl-4-methoxycyclohexane.
Chemical Property Profile of 1-Tert-butyl-4-methoxycyclohexane
Property Insights of 1-Tert-butyl-4-methoxycyclohexane
The XLogP value of 3.6 indicates that 1-Tert-butyl-4-methoxycyclohexane 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-Tert-butyl-4-methoxycyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Tert-butyl-4-methoxycyclohexane 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-Tert-butyl-4-methoxycyclohexane?
The CAS number of 1-Tert-butyl-4-methoxycyclohexane is 74052-93-0.
What is the molecular formula of 1-Tert-butyl-4-methoxycyclohexane?
The molecular formula of 1-Tert-butyl-4-methoxycyclohexane is C11H22O.
What is the molecular weight of 1-Tert-butyl-4-methoxycyclohexane?
The molecular weight of 1-Tert-butyl-4-methoxycyclohexane is 170.17 g/mol.
Where can I buy 1-Tert-butyl-4-methoxycyclohexane?
You can request a quote for 1-Tert-butyl-4-methoxycyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tert-butyl-4-methoxycyclohexane?
Yes, KEHONG BIO provides custom synthesis services for 1-Tert-butyl-4-methoxycyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.