| CAS Number | 887350-82-5 |
| Catalog Number | AG01A42S(AGN-PC-0WO55N) |
| Chemical Name | 2-Chloro-5-methanesulfonylthiophene-3-sulfonyl chloride |
| IUPAC Name | 2-chloro-5-methylsulfonylthiophene-3-sulfonyl chloride |
| InChI | InChI=1S/C5H4Cl2O4S3/c1-13(8,9)4-2-3(5(6)12-4)14(7,10)11/h2H,1H3 |
| InChI Key | HIIURPCOJNWBNU-UHFFFAOYSA-N |
| MDL Number | MFCD08448263 |
| Molecular Formula | C5H4Cl2O4S3 |
| Molecular Weight | 295.1839 |
| SMILES | CS(C1SC(Cl)=C(S(Cl)(=O)=O)C=1)(=O)=O |
| Synonyms | 2-chloro-5-methanesulfonylthiophene-3-sulfonyl chloride,
887350-82-5,
AKOS026727779,
ZINC100470882,
NE32299,
2-Chloro-5-(methylsulfonyl)-3-thiophenesulfonyl chloride,
|
| Complexity | 403 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 293.865g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 295.163g/mol |
| Monoisotopic Mass | 293.865g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 113A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number