3-Quinuclidinone ethyleneketal
TL;DR: 3-Quinuclidinone ethyleneketal (CAS 26814-49-3) is a chemical compound with molecular formula C9H15NO2 and molecular weight 169.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
spiro[1,3-dioxolane-2,3'-1-azabicyclo[2.2.2]octane]
Also Known As: 3-Quinuclidinone ethyleneketal, 3-quinuclidone ethyleneketal, 3-Oxoquinuclidine ehylene acetal, spiro[1,3-dioxolane-2,3'-1-azabicyclo[2.2.2]octane], Spiro[4-azabicyclo[2.2.2]octane-2,2'-[1,3]dioxolane]
| Molecular Formula | C9H15NO2 |
|---|---|
| Molecular Weight | 169.11 g/mol |
| LogP | 0.4551 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 169.11028 |
| Heavy Atoms | 12 |
| Complexity | 180.96756 |
Chemical Identifiers
| CAS Number | 26814-49-3 |
|---|---|
| SMILES | C1CN2CCC1C3(C2)OCCO3 |
Product Overview
3-Quinuclidinone ethyleneketal (CAS 26814-49-3), with molecular formula C9H15NO2 and molecular weight 169.11 g/mol. IUPAC: spiro[1,3-dioxolane-2,3'-1-azabicyclo[2.2.2]octane].
Chemical Property Profile of 3-Quinuclidinone ethyleneketal
Property Insights of 3-Quinuclidinone ethyleneketal
The XLogP value of 0.4551 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Quinuclidinone ethyleneketal. With a topological polar surface area (TPSA) of 21.7 Ų, 3-Quinuclidinone ethyleneketal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Quinuclidinone ethyleneketal 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 3-Quinuclidinone ethyleneketal?
The CAS number of 3-Quinuclidinone ethyleneketal is 26814-49-3.
What is the molecular formula of 3-Quinuclidinone ethyleneketal?
The molecular formula of 3-Quinuclidinone ethyleneketal is C9H15NO2.
What is the molecular weight of 3-Quinuclidinone ethyleneketal?
The molecular weight of 3-Quinuclidinone ethyleneketal is 169.11 g/mol.
Where can I buy 3-Quinuclidinone ethyleneketal?
You can request a quote for 3-Quinuclidinone ethyleneketal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Quinuclidinone ethyleneketal?
Yes, KEHONG BIO provides custom synthesis services for 3-Quinuclidinone ethyleneketal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.