Methyl quinuclidine-2-carboxylate
TL;DR: Methyl quinuclidine-2-carboxylate (CAS 30740-19-3) 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.
methyl 1-azabicyclo[2.2.2]octane-2-carboxylate
Also Known As: Methyl quinuclidine-2-carboxylate, Quinuclidine-2-carboxylic acid, methyl ester, 2-carbomethoxy-1-azabicyclo[2.2.2]octane, quinuclidine-2-carboxylic acid methyl ester, methyl 1-azabicyclo[2.2.2]octane-2-carboxylate
| Molecular Formula | C9H15NO2 |
|---|---|
| Molecular Weight | 169.11 g/mol |
| LogP | 0.6437 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.11028 |
| Heavy Atoms | 12 |
| Complexity | 184.96756 |
Chemical Identifiers
| CAS Number | 30740-19-3 |
|---|---|
| SMILES | COC(=O)C1CC2CCN1CC2 |
Product Overview
Methyl quinuclidine-2-carboxylate (CAS 30740-19-3), with molecular formula C9H15NO2 and molecular weight 169.11 g/mol. IUPAC: methyl 1-azabicyclo[2.2.2]octane-2-carboxylate.
Chemical Property Profile of Methyl quinuclidine-2-carboxylate
Property Insights of Methyl quinuclidine-2-carboxylate
The XLogP value of 0.6437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl quinuclidine-2-carboxylate. With a topological polar surface area (TPSA) of 29.54 Ų, Methyl quinuclidine-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl quinuclidine-2-carboxylate 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 Methyl quinuclidine-2-carboxylate?
The CAS number of Methyl quinuclidine-2-carboxylate is 30740-19-3.
What is the molecular formula of Methyl quinuclidine-2-carboxylate?
The molecular formula of Methyl quinuclidine-2-carboxylate is C9H15NO2.
What is the molecular weight of Methyl quinuclidine-2-carboxylate?
The molecular weight of Methyl quinuclidine-2-carboxylate is 169.11 g/mol.
Where can I buy Methyl quinuclidine-2-carboxylate?
You can request a quote for Methyl quinuclidine-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl quinuclidine-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl quinuclidine-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.