| CAS Number | 1564905-81-2 |
| Catalog Number | AG01B3IY |
| Chemical Name | 2-(2,6-difluorophenyl)ethane-1-sulfonyl chloride |
| IUPAC Name | 2-(2,6-difluorophenyl)ethanesulfonyl chloride |
| InChI | InChI=1S/C8H7ClF2O2S/c9-14(12,13)5-4-6-7(10)2-1-3-8(6)11/h1-3H,4-5H2 |
| InChI Key | FUFBQWQNKRRDEH-UHFFFAOYSA-N |
| MDL Number | MFCD26064603 |
| Molecular Formula | C8H7ClF2O2S |
| Molecular Weight | 240.6548 |
| SMILES | FC1=C(CCS(Cl)(=O)=O)C(F)=CC=C1 |
| Synonyms | 2-(2,6-difluorophenyl)ethane-1-sulfonyl chloride,
1564905-81-2,
ZINC156940509,
|
| Complexity | 266 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.982g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.649g/mol |
| Monoisotopic Mass | 239.982g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number