| CAS Number | 885532-56-9 |
| Catalog Number | AG00GUFK(AGN-PC-0WD88T) |
| Chemical Name | 3-BROMO-5-CHLORO-2-METHOXYBENZENESULFONYL CHLORIDE |
| IUPAC Name | 3-bromo-5-chloro-2-methoxybenzenesulfonyl chloride |
| InChI | InChI=1S/C7H5BrCl2O3S/c1-13-7-5(8)2-4(9)3-6(7)14(10,11)12/h2-3H,1H3 |
| InChI Key | WFEMSAFZOIOVAI-UHFFFAOYSA-N |
| MDL Number | MFCD08444540 |
| Molecular Formula | C7H5BrCl2O3S |
| Molecular Weight | 319.9878 |
| SMILES | BrC=1C(=C(C=C(C1)Cl)S(=O)(=O)Cl)OC |
| Synonyms | 3-bromo-5-chloro-2-methoxybenzenesulfonyl chloride,
885532-56-9,
3-bromo-5-chloro-2-methoxybenzene-1-sulfonyl chloride,
AC1Q44VV,
CTK6J3907,
AKOS000141918,
ZINC100549775,
MCULE-4586964814,
NE23089,
EN300-29499,
J-511995,
3-bromo-5-chloro-2-methoxy-benzene-1-sulfonylchloride,
|
| Complexity | 290 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 317.852g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 319.978g/mol |
| Monoisotopic Mass | 317.852g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number