![1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride structure](/static/products/5276/52763-22-1.webp)
1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride
TL;DR: 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride (CAS 52763-22-1) is a chemical compound with molecular formula C10H16ClNO3 and molecular weight 233.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-oxo-1-azabicyclo[2.2.2]octane-2-carboxylate;hydrochloride
Also Known As: 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride, Ethyl 3-quinuclidinone-2-carboxylate hydrochloride, ethyl 3-oxo-1-azabicyclo[2.2.2]octane-2-carboxylate;hydrochloride, ethyl 3-oxo-1-azabicyclo[2.2.2]octane-2-carboxylate,hydrochloride, ethyl 3-oxo-1-azabicyclo[2.2.2]octane-2-carboxylate hydrochloride
| Molecular Formula | C10H16ClNO3 |
|---|---|
| Molecular Weight | 233.08 g/mol |
| LogP | 0.6346 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.08188 |
| Heavy Atoms | 15 |
| Complexity | 261.39313 |
Chemical Identifiers
| CAS Number | 52763-22-1 |
|---|---|
| SMILES | CCOC(=O)C1C(=O)C2CCN1CC2.Cl |
Product Overview
1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride (CAS 52763-22-1), with molecular formula C10H16ClNO3 and molecular weight 233.08 g/mol. IUPAC: ethyl 3-oxo-1-azabicyclo[2.2.2]octane-2-carboxylate;hydrochloride.
Chemical Property Profile of 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride
Property Insights of 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride
The XLogP value of 0.6346 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride. With a topological polar surface area (TPSA) of 46.61 Ų, 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride has 0 hydrogen bond donor(s) and 4 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-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride?
The CAS number of 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride is 52763-22-1.
What is the molecular formula of 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride?
The molecular formula of 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride is C10H16ClNO3.
What is the molecular weight of 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride?
The molecular weight of 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride is 233.08 g/mol.
Where can I buy 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride?
You can request a quote for 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Azabicyclo[2.2.2]octane-2-carboxylic acid, 3-oxo-, ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.