2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline
TL;DR: 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline (CAS 100331-02-0) is a chemical compound with molecular formula C8H6F5NOS and molecular weight 259.00903 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline
Also Known As: 2-fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline, 2-FLUORO-4-(1,1,2,2-TETRAFLUOROETHANESULFINYL)ANILINE, Benzenamine, 2-fluoro-4-[(1,1,2,2-tetrafluoroethyl)sulfinyl]-, Butanoic acid, 3-bromo-2,2-dimethyl-4-[(1-methyl-1-phenylethyl)amino]-4-oxo-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H6F5NOS |
| Molecular Weight | 259.00903 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 62.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.00903 Da |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
| SMILES | C1=CC(=C(C=C1S(=O)C(C(F)F)(F)F)F)N |
| InChIKey | WBDXBSZDDNSGKU-UHFFFAOYSA-N |
Chemical Property Profile of 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline
Property Insights of 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline. The TPSA of 62.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline. Following Lipinski's Rule of Five, 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline?
The CAS number of 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline is 100331-02-0.
What is the molecular formula of 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline?
The molecular formula of 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline is C8H6F5NOS.
What is the molecular weight of 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline?
The molecular weight of 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline is 259.00903 g/mol.
Where can I buy 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline?
You can request a quote for 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline?
Yes, CoreyChem provides custom synthesis services for 2-Fluoro-4-(1,1,2,2-tetrafluoroethylsulfinyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.