| CAS Number | 942199-60-2 |
| Catalog Number | AG00GVQQ(AGN-PC-0WB5V5) |
| Chemical Name | 4-Chloro-3-methoxybenzene-1-sulfonyl chloride |
| IUPAC Name | 4-chloro-3-methoxybenzenesulfonyl chloride |
| InChI | InChI=1S/C7H6Cl2O3S/c1-12-7-4-5(13(9,10)11)2-3-6(7)8/h2-4H,1H3 |
| InChI Key | RHOMFRDKCUYVOH-UHFFFAOYSA-N |
| MDL Number | MFCD12402639 |
| Molecular Formula | C7H6Cl2O3S |
| Molecular Weight | 241.0917 |
| SMILES | COC1=C(C=CC(=C1)S(=O)(=O)Cl)Cl |
| Synonyms | 942199-60-2,
4-CHLORO-3-METHOXYBENZENESULFONYL CHLORIDE,
4-Chloro-3-methoxybenzene-1-sulfonyl chloride,
4-Chloro-3-methoxy-benzenesulfonyl chloride,
SCHEMBL1939505,
DTXSID40678904,
RHOMFRDKCUYVOH-UHFFFAOYSA-N,
MFCD12402639,
SBB081983,
AKOS005139204,
ZINC100153525,
chloro(4-chloro-3-methoxyphenyl)sulfone,
4-chloro-3-methoxy-benzene sulfonyl chloride,
Y-7197,
4-chloro-3-methoxybenzenesulfonyl chloride(SALTDATA,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.941g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.082g/mol |
| Monoisotopic Mass | 239.941g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number