2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-
TL;DR: 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)- (CAS 60028-21-9) is a chemical compound with molecular formula C11H20O3 and molecular weight 200.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4-di(propan-2-yl)-2,6,7-trioxabicyclo[2.2.2]octane
Also Known As: 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-, 1,4-Bis(1-methylethyl)-2,6,7-trioxabicyclo(2.2.2)octane, 1,4-di(propan-2-yl)-3,5,8-trioxabicyclo[2.2.2]octane, 1,4-Di(propan-2-yl)-2,6,7-trioxabicyclo[2.2.2]octane, RefChem:247901
| Molecular Formula | C11H20O3 |
|---|---|
| Molecular Weight | 200.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.14125 |
| Heavy Atoms | 14 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 60028-21-9 |
|---|---|
| SMILES | CC(C)C12COC(OC1)(OC2)C(C)C |
| InChIKey | QYPQGJPVSZEXAV-UHFFFAOYSA-N |
Product Overview
2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)- (CAS 60028-21-9), with molecular formula C11H20O3 and molecular weight 200.14 g/mol. IUPAC: 1,4-di(propan-2-yl)-2,6,7-trioxabicyclo[2.2.2]octane.
Chemical Property Profile of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-
Property Insights of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-. With a topological polar surface area (TPSA) of 27.7 Ų, 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)- has 0 hydrogen bond donor(s) and 3 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 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-?
The CAS number of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)- is 60028-21-9.
What is the molecular formula of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-?
The molecular formula of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)- is C11H20O3.
What is the molecular weight of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-?
The molecular weight of 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)- is 200.14 g/mol.
Where can I buy 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-?
You can request a quote for 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2,6,7-Trioxabicyclo(2.2.2)octane, 1,4-bis(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.