3,4,5-Trifluorobenzenesulfonyl chloride
TL;DR: 3,4,5-Trifluorobenzenesulfonyl chloride (CAS 1185299-43-7) is a chemical compound with molecular formula C6H2ClF3O2S and molecular weight 229.94162 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4,5-trifluorobenzenesulfonyl chloride
Also Known As: 3,4,5-Trifluorobenzenesulfonyl chloride, 3,4,5-Trifluorobenzene-1-sulfonyl chloride, 3,4,5-trifluorobenzenesulfonylchloride, 3,4,5-trifluorobenzenesulphonyl chloride, Benzenesulfonyl chloride, 3,4,5-trifluoro-
Technical Specifications
| Molecular Formula | C6H2ClF3O2S |
| Molecular Weight | 229.94162 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 229.94162 Da |
| Heavy Atoms | 13 |
| Complexity | 264.0 |
| SMILES | C1=C(C=C(C(=C1F)F)F)S(=O)(=O)Cl |
| InChIKey | HSEHKULCGSMHAE-UHFFFAOYSA-N |
Chemical Property Profile of 3,4,5-Trifluorobenzenesulfonyl chloride
Property Insights of 3,4,5-Trifluorobenzenesulfonyl chloride
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,5-Trifluorobenzenesulfonyl chloride. With a topological polar surface area (TPSA) of 42.5 Ų, 3,4,5-Trifluorobenzenesulfonyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-Trifluorobenzenesulfonyl chloride has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,4,5-Trifluorobenzenesulfonyl chloride?
The CAS number of 3,4,5-Trifluorobenzenesulfonyl chloride is 1185299-43-7.
What is the molecular formula of 3,4,5-Trifluorobenzenesulfonyl chloride?
The molecular formula of 3,4,5-Trifluorobenzenesulfonyl chloride is C6H2ClF3O2S.
What is the molecular weight of 3,4,5-Trifluorobenzenesulfonyl chloride?
The molecular weight of 3,4,5-Trifluorobenzenesulfonyl chloride is 229.94162 g/mol.
Where can I buy 3,4,5-Trifluorobenzenesulfonyl chloride?
You can request a quote for 3,4,5-Trifluorobenzenesulfonyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4,5-Trifluorobenzenesulfonyl chloride?
Yes, CoreyChem provides custom synthesis services for 3,4,5-Trifluorobenzenesulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.