己基叔丁基醚
TL;DR: 己基叔丁基醚 (CAS 69775-79-7) is a chemical compound with molecular formula C10H22O and molecular weight 158.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
己基叔丁基醚
1-[(2-methylpropan-2-yl)oxy]hexane
Also Known As: tert-Butyl n-hexyl ether, hexyl t-butyl ether, 1-(TERT-BUTOXY)HEXANE, 1-tert-butoxyhexane, 6-t-butoxyhexane
| Molecular Formula | C10H22O |
|---|---|
| Molecular Weight | 158.17 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 158.16707 |
| Heavy Atoms | 11 |
| Complexity | 81.0 |
Chemical Identifiers
| CAS Number | 69775-79-7 |
|---|---|
| SMILES | CCCCCCOC(C)(C)C |
| InChIKey | XSBHWHZJHSUCOI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
己基叔丁基醚 (CAS 69775-79-7), with molecular formula C10H22O and molecular weight 158.17 g/mol. IUPAC: 1-[(2-methylpropan-2-yl)oxy]hexane.
Chemical Property Profile of 己基叔丁基醚
Property Insights of 己基叔丁基醚
The XLogP value of 3.4 indicates that 己基叔丁基醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 己基叔丁基醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 己基叔丁基醚 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 己基叔丁基醚?
The CAS number of 己基叔丁基醚 is 69775-79-7.
What is the molecular formula of 己基叔丁基醚?
The molecular formula of 己基叔丁基醚 is C10H22O.
What is the molecular weight of 己基叔丁基醚?
The molecular weight of 己基叔丁基醚 is 158.17 g/mol.
Where can I buy 己基叔丁基醚?
You can request a quote for 己基叔丁基醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 己基叔丁基醚?
Yes, KEHONG BIO provides custom synthesis services for 己基叔丁基醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.