| CAS Number | 1214372-88-9 |
| Catalog Number | AG01BPW0 |
| Chemical Name | 3-Fluoro-2-(trifluoromethyl)benzenesulfonyl chloride |
| IUPAC Name | 3-fluoro-2-(trifluoromethyl)benzenesulfonyl chloride |
| InChI | InChI=1S/C7H3ClF4O2S/c8-15(13,14)5-3-1-2-4(9)6(5)7(10,11)12/h1-3H |
| InChI Key | IBPLJUDUCKFLHS-UHFFFAOYSA-N |
| MDL Number | MFCD13185644 |
| Molecular Formula | C7H3ClF4O2S |
| Molecular Weight | 262.6091 |
| SMILES | FC=1C(=C(C=CC1)S(=O)(=O)Cl)C(F)(F)F |
| Synonyms | 1214372-88-9,
3-FLUORO-2-(TRIFLUOROMETHYL)BENZENE-1-SULFONYL CHLORIDE,
AKOS024118570,
ZINC218480113,
3-fluoro-2-(trifluoromethyl)benzenesulfonyl chloride,
|
| Complexity | 321 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 261.948g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 262.603g/mol |
| Monoisotopic Mass | 261.948g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number