3-Cyano-2,4,5,6-tetrafluorobenzamide
TL;DR: 3-Cyano-2,4,5,6-tetrafluorobenzamide (CAS 159847-72-0) is a chemical compound with molecular formula C8H2F4N2O and molecular weight 218.01033 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-cyano-2,4,5,6-tetrafluorobenzamide
Also Known As: 3-cyano-2,4,5,6-tetrafluorobenzamide, 3-cyano-2,4,5,6-tetrafluoro-benzamide
Technical Specifications
| Molecular Formula | C8H2F4N2O |
| Molecular Weight | 218.01033 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.01033 Da |
| Heavy Atoms | 15 |
| Complexity | 315.0 |
| SMILES | C(#N)C1=C(C(=C(C(=C1F)F)F)C(=O)N)F |
| InChIKey | WMNNILBXIBTXNM-UHFFFAOYSA-N |
Chemical Property Profile of 3-Cyano-2,4,5,6-tetrafluorobenzamide
Property Insights of 3-Cyano-2,4,5,6-tetrafluorobenzamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Cyano-2,4,5,6-tetrafluorobenzamide. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Cyano-2,4,5,6-tetrafluorobenzamide. Following Lipinski's Rule of Five, 3-Cyano-2,4,5,6-tetrafluorobenzamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Cyano-2,4,5,6-tetrafluorobenzamide?
The CAS number of 3-Cyano-2,4,5,6-tetrafluorobenzamide is 159847-72-0.
What is the molecular formula of 3-Cyano-2,4,5,6-tetrafluorobenzamide?
The molecular formula of 3-Cyano-2,4,5,6-tetrafluorobenzamide is C8H2F4N2O.
What is the molecular weight of 3-Cyano-2,4,5,6-tetrafluorobenzamide?
The molecular weight of 3-Cyano-2,4,5,6-tetrafluorobenzamide is 218.01033 g/mol.
Where can I buy 3-Cyano-2,4,5,6-tetrafluorobenzamide?
You can request a quote for 3-Cyano-2,4,5,6-tetrafluorobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Cyano-2,4,5,6-tetrafluorobenzamide?
Yes, CoreyChem provides custom synthesis services for 3-Cyano-2,4,5,6-tetrafluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.