![8-Azabicyclo[3.2.1]octan-2-one structure](/static/products/958/958812-40-3.png)
8-Azabicyclo[3.2.1]octan-2-one
TL;DR: 8-Azabicyclo[3.2.1]octan-2-one (CAS 958812-40-3) is a chemical compound with molecular formula C7H11NO and molecular weight 125.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-azabicyclo[3.2.1]octan-2-one
Also Known As: 8-azabicyclo[3.2.1]octan-2-one, 8-azabicyclo[3.2.1]octan-4-one, 8-Azabicyclo[3.2.1]octan-2-one hydrochloride, Q-4584
| Molecular Formula | C7H11NO |
|---|---|
| Molecular Weight | 125.08 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 125.08406 |
| Heavy Atoms | 9 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 958812-40-3 |
|---|---|
| SMILES | C1CC2C(=O)CCC1N2 |
| InChIKey | YCJKSIIIDRILDS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
8-Azabicyclo[3.2.1]octan-2-one (CAS 958812-40-3), with molecular formula C7H11NO and molecular weight 125.08 g/mol. IUPAC: 8-azabicyclo[3.2.1]octan-2-one.
Chemical Property Profile of 8-Azabicyclo[3.2.1]octan-2-one
Property Insights of 8-Azabicyclo[3.2.1]octan-2-one
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Azabicyclo[3.2.1]octan-2-one. With a topological polar surface area (TPSA) of 29.1 Ų, 8-Azabicyclo[3.2.1]octan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Azabicyclo[3.2.1]octan-2-one 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 8-Azabicyclo[3.2.1]octan-2-one?
The CAS number of 8-Azabicyclo[3.2.1]octan-2-one is 958812-40-3.
What is the molecular formula of 8-Azabicyclo[3.2.1]octan-2-one?
The molecular formula of 8-Azabicyclo[3.2.1]octan-2-one is C7H11NO.
What is the molecular weight of 8-Azabicyclo[3.2.1]octan-2-one?
The molecular weight of 8-Azabicyclo[3.2.1]octan-2-one is 125.08 g/mol.
Where can I buy 8-Azabicyclo[3.2.1]octan-2-one?
You can request a quote for 8-Azabicyclo[3.2.1]octan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Azabicyclo[3.2.1]octan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 8-Azabicyclo[3.2.1]octan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.