| CAS Number | 728919-57-1 |
| Catalog Number | AG00FF89 |
| Chemical Name | 2-(2-Chlorophenyl)ethanesulfonyl chloride |
| IUPAC Name | 2-(2-chlorophenyl)ethanesulfonyl chloride |
| InChI | InChI=1S/C8H8Cl2O2S/c9-8-4-2-1-3-7(8)5-6-13(10,11)12/h1-4H,5-6H2 |
| InChI Key | BRMWJQBTZLQTIP-UHFFFAOYSA-N |
| MDL Number | MFCD04117451 |
| Molecular Formula | C8H8Cl2O2S |
| Molecular Weight | 239.1189 |
| SMILES | ClC1=C(CCS(Cl)(=O)=O)C=CC=C1 |
| Synonyms | 2-(2-chlorophenyl)ethanesulfonyl Chloride,
728919-57-1,
2-(2-Chloro-phenyl)-ethanesulfonyl chloride,
AC1MBWNC,
SCHEMBL786089,
CTK6H3268,
MFCD04117451,
ZINC95698267,
AKOS006223417,
2-(2-chlorophenyl)-ethanesulfonyl chloride,
2-(2-chlorophenyl)ethane-1-sulfonyl chloride,
CID2757778,
|
| Complexity | 245 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.962g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.11g/mol |
| Monoisotopic Mass | 237.962g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number