![Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile structure](/static/products/1017/1017-93-2.webp)
Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile
TL;DR: Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile (CAS 1017-93-2) is a chemical compound with molecular formula C12H8N4 and molecular weight 208.07489 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile
Also Known As: Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile, 4-09-00-03799 (Beilstein Handbook Reference), BICYCLO(2.2.2)OCT-5-ENE-2,2,3,3-TETRACARBONITRILE, 2,2,3,3-Tetracyano bicyclo <2,2,2> octen, 2,2,3,3-tetra-cyanobicyclo[2.2.2]oct-5-ene
Technical Specifications
| Molecular Formula | C12H8N4 |
| Molecular Weight | 208.07489 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 95.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.07489 Da |
| Heavy Atoms | 16 |
| Complexity | 477.0 |
| SMILES | C1CC2C=CC1C(C2(C#N)C#N)(C#N)C#N |
| InChIKey | GFDRDNGZQZLSRI-UHFFFAOYSA-N |
Chemical Property Profile of Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile
Property Insights of Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile. Following Lipinski's Rule of Five, Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile?
The CAS number of Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile is 1017-93-2.
What is the molecular formula of Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile?
The molecular formula of Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile is C12H8N4.
What is the molecular weight of Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile?
The molecular weight of Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile is 208.07489 g/mol.
Where can I buy Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile?
You can request a quote for Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile?
Yes, CoreyChem provides custom synthesis services for Bicyclo[2.2.2]oct-5-ene-2,2,3,3-tetracarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.