2-Methylquinuclidin-3-ol
TL;DR: 2-Methylquinuclidin-3-ol (CAS 3952-61-2) is a chemical compound with molecular formula C8H15NO and molecular weight 141.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1-azabicyclo[2.2.2]octan-3-ol
Also Known As: 2-Methylquinuclidin-3-ol, 2-methyl-1-azabicyclo[2.2.2]octan-3-ol, 2-methyl-3-quinuclidinol, 2-methyl-3-hydroxyquinuclidine, 2-Methyl-1-azabicyclo(2.2.2)octan-3-ol
| Molecular Formula | C8H15NO |
|---|---|
| Molecular Weight | 141.12 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 141.11537 |
| Heavy Atoms | 10 |
| Complexity | 129.0 |
Chemical Identifiers
| CAS Number | 3952-61-2 |
|---|---|
| SMILES | CC1C(C2CCN1CC2)O |
| InChIKey | VLJPCCPJHQAAQB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methylquinuclidin-3-ol (CAS 3952-61-2), with molecular formula C8H15NO and molecular weight 141.12 g/mol. IUPAC: 2-methyl-1-azabicyclo[2.2.2]octan-3-ol.
Chemical Property Profile of 2-Methylquinuclidin-3-ol
Property Insights of 2-Methylquinuclidin-3-ol
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylquinuclidin-3-ol. With a topological polar surface area (TPSA) of 23.5 Ų, 2-Methylquinuclidin-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylquinuclidin-3-ol has 1 hydrogen bond donor(s) and 2 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-Methylquinuclidin-3-ol?
The CAS number of 2-Methylquinuclidin-3-ol is 3952-61-2.
What is the molecular formula of 2-Methylquinuclidin-3-ol?
The molecular formula of 2-Methylquinuclidin-3-ol is C8H15NO.
What is the molecular weight of 2-Methylquinuclidin-3-ol?
The molecular weight of 2-Methylquinuclidin-3-ol is 141.12 g/mol.
Where can I buy 2-Methylquinuclidin-3-ol?
You can request a quote for 2-Methylquinuclidin-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylquinuclidin-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylquinuclidin-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.