| CAS Number | 900814-26-8 |
| Catalog Number | AG01B37U |
| Chemical Name | 3-Bromo-4-chlorobenzenesulfonamide |
| IUPAC Name | 3-bromo-4-chlorobenzenesulfonamide |
| InChI | InChI=1S/C6H5BrClNO2S/c7-5-3-4(12(9,10)11)1-2-6(5)8/h1-3H,(H2,9,10,11) |
| InChI Key | NMUHWVSVCUNDCY-UHFFFAOYSA-N |
| MDL Number | MFCD18089337 |
| Molecular Formula | C6H5BrClNO2S |
| Molecular Weight | 270.5314 |
| SMILES | C1=CC(=C(C=C1S(=O)(=O)N)Br)Cl |
| Synonyms | 3-Bromo-4-chlorobenzenesulfonamide,
900814-26-8,
SCHEMBL5805029,
ZINC67796614,
AKOS017558250,
Benzenesulfonamide, 3-bromo-4-chloro-,
|
| Complexity | 251 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 268.891g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.525g/mol |
| Monoisotopic Mass | 268.891g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 68.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number