| CAS Number | 612541-13-6 |
| Catalog Number | AG019KO3(AGN-PC-0NKS7Y) |
| Chemical Name | 4-Chloro-2-methoxybenzene-1-sulfonyl chloride |
| IUPAC Name | 4-chloro-2-methoxybenzenesulfonyl chloride |
| InChI | InChI=1S/C7H6Cl2O3S/c1-12-6-4-5(8)2-3-7(6)13(9,10)11/h2-4H,1H3 |
| InChI Key | JIFZOSWXWRNSFB-UHFFFAOYSA-N |
| MDL Number | MFCD18393569 |
| Molecular Formula | C7H6Cl2O3S |
| Molecular Weight | 241.0917 |
| SMILES | COC1=C(S(Cl)(=O)=O)C=CC(Cl)=C1 |
| Synonyms | 4-chloro-2-methoxybenzene-1-sulfonyl chloride,
612541-13-6,
SCHEMBL2947794,
ZINC59281343,
AKOS006220451,
NE26214,
EN300-27694,
|
| 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 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number