![5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene structure](/static/products/100/1005183-95-8.webp)
5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene
TL;DR: 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene (CAS 1005183-95-8) is a chemical compound with molecular formula C13H15N and molecular weight 185.12045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-phenyl-1-azabicyclo[2.2.2]oct-2-ene
Also Known As: 5-phenyl-1-azabicyclo[2.2.2]oct-2-ene, AO-365/15162031
Technical Specifications
| Molecular Formula | C13H15N |
| Molecular Weight | 185.12045 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 185.12045 Da |
| Heavy Atoms | 14 |
| Complexity | 227.0 |
| SMILES | C1CN2CC(C1C=C2)C3=CC=CC=C3 |
| InChIKey | XXXSCUCFBYKATL-UHFFFAOYSA-N |
Chemical Property Profile of 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene
Property Insights of 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene. With a topological polar surface area (TPSA) of 3.2 Ų, 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene?
The CAS number of 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene is 1005183-95-8.
What is the molecular formula of 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene?
The molecular formula of 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene is C13H15N.
What is the molecular weight of 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene?
The molecular weight of 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene is 185.12045 g/mol.
Where can I buy 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene?
You can request a quote for 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene?
Yes, CoreyChem provides custom synthesis services for 5-Phenyl-1-azabicyclo[2.2.2]oct-2-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.