![7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one structure](/static/products/1719/17198-06-0.webp)
7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one
TL;DR: 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one (CAS 17198-06-0) is a chemical compound with molecular formula C9H9NO and molecular weight 147.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-azabicyclo[4.2.2]deca-2,4,9-trien-8-one
Also Known As: 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one, (2Z,4Z)-7-azabicyclo[4.2.2]deca-2,4,9-trien-8-one
| Molecular Formula | C9H9NO |
|---|---|
| Molecular Weight | 147.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 147.06842 |
| Heavy Atoms | 11 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 17198-06-0 |
|---|---|
| SMILES | C1=CC2C=CC(C=C1)NC2=O |
| InChIKey | OTDUKMQLDZYJCD-UHFFFAOYSA-N |
Product Overview
7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one (CAS 17198-06-0), with molecular formula C9H9NO and molecular weight 147.07 g/mol. IUPAC: 7-azabicyclo[4.2.2]deca-2,4,9-trien-8-one.
Chemical Property Profile of 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one
Property Insights of 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one. With a topological polar surface area (TPSA) of 29.1 Ų, 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one has 1 hydrogen bond donor(s) and 1 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 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one?
The CAS number of 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one is 17198-06-0.
What is the molecular formula of 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one?
The molecular formula of 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one is C9H9NO.
What is the molecular weight of 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one?
The molecular weight of 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one is 147.07 g/mol.
Where can I buy 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one?
You can request a quote for 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Azabicyclo[4.2.2]deca-2,4,9-trien-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.