| CAS Number | 335281-13-5 |
| Catalog Number | AG00IW95(AGN-PC-0WAY69) |
| Chemical Name | 2-(2-Chlorophenyl)ethene-1-sulfonyl chloride |
| IUPAC Name | 2-(2-chlorophenyl)ethenesulfonyl chloride |
| InChI | InChI=1S/C8H6Cl2O2S/c9-8-4-2-1-3-7(8)5-6-13(10,11)12/h1-6H |
| InChI Key | AUJUFTDORPTZBS-UHFFFAOYSA-N |
| MDL Number | MFCD04973463 |
| Molecular Formula | C8H6Cl2O2S |
| Molecular Weight | 237.1030 |
| SMILES | ClC1=C(C=CS(Cl)(=O)=O)C=CC=C1 |
| Synonyms | 335281-13-5,
2-(2-Chlorophenyl) ethenesulfonyl chloride,
AUJUFTDORPTZBS-UHFFFAOYSA-N,
KS-000022RO,
AKOS030245855,
2-(2-chloro-phenyl)-ethenesulfonyl chloride,
2-(2-chlorophenyl)ethene-1-sulfonyl chloride,
|
| Complexity | 279 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.947g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.094g/mol |
| Monoisotopic Mass | 235.947g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number