| CAS Number | 1261730-58-8 |
| Catalog Number | AG019YSV |
| Chemical Name | 4-Chloro-2-iodobenzene-1-sulfonyl chloride |
| IUPAC Name | 4-chloro-2-iodobenzenesulfonyl chloride |
| InChI | InChI=1S/C6H3Cl2IO2S/c7-4-1-2-6(5(9)3-4)12(8,10)11/h1-3H |
| InChI Key | VJUBZEVHIUAKHU-UHFFFAOYSA-N |
| MDL Number | MFCD18393342 |
| Molecular Formula | C6H3Cl2IO2S |
| Molecular Weight | 336.9623 |
| SMILES | ClC1=CC(I)=C(S(Cl)(=O)=O)C=C1 |
| Synonyms | 1261730-58-8,
4-Chloro-2-iodobenzenesulfonyl chloride,
4-chloro-2-iodobenzene-1-sulfonyl chloride,
MFCD18393342,
ZINC97972528,
AKOS017552969,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 335.828g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 336.952g/mol |
| Monoisotopic Mass | 335.828g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number