| CAS Number | 1782813-28-8 |
| Catalog Number | AG01DYXC |
| Chemical Name | 2-(1,1-difluoroethyl)benzene-1-sulfonyl chloride |
| IUPAC Name | 2-(1,1-difluoroethyl)benzenesulfonyl chloride |
| InChI | InChI=1S/C8H7ClF2O2S/c1-8(10,11)6-4-2-3-5-7(6)14(9,12)13/h2-5H,1H3 |
| InChI Key | YTAASPNHFRBFRN-UHFFFAOYSA-N |
| MDL Number | MFCD28534976 |
| Molecular Formula | C8H7ClF2O2S |
| Molecular Weight | 240.6548 |
| SMILES | CC(C1=C(S(Cl)(=O)=O)C=CC=C1)(F)F |
| Synonyms | AKOS024109237,
2-(1,1-difluoroethyl)benzene-1-sulfonyl chloride,
1782813-28-8,
|
| Complexity | 297 |
| 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 | 2 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number