| CAS Number | 1214350-72-7 |
| Catalog Number | AG019TJ0(AGN-PC-0WNNUY) |
| Chemical Name | 3-Fluoro-5-methylbenzene-1-sulfonyl chloride |
| IUPAC Name | 3-fluoro-5-methylbenzenesulfonyl chloride |
| InChI | InChI=1S/C7H6ClFO2S/c1-5-2-6(9)4-7(3-5)12(8,10)11/h2-4H,1H3 |
| InChI Key | NVUHCPPLBJCKCJ-UHFFFAOYSA-N |
| MDL Number | MFCD13185611 |
| Molecular Formula | C7H6ClFO2S |
| Molecular Weight | 208.6377 |
| SMILES | FC=1C=C(C=C(C1)C)S(=O)(=O)Cl |
| Synonyms | 3-FLUORO-5-METHYLBENZENE-1-SULFONYL CHLORIDE,
1214350-72-7,
3-Fluoro-5-methylbenzenesulfonyl chloride,
AKOS006333133,
ZINC100550881,
AB66780,
NE15688,
|
| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.976g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.631g/mol |
| Monoisotopic Mass | 207.976g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number