| CAS Number | 1266466-05-0 |
| Catalog Number | AG019ETJ |
| Chemical Name | 4-Bromo-N-(4-chloro-3-methylphenyl)benzenesulfonamide |
| IUPAC Name | 4-bromo-N-(4-chloro-3-methylphenyl)benzenesulfonamide |
| InChI | InChI=1S/C13H11BrClNO2S/c1-9-8-11(4-7-13(9)15)16-19(17,18)12-5-2-10(14)3-6-12/h2-8,16H,1H3 |
| InChI Key | ASKSOVCLNZMARA-UHFFFAOYSA-N |
| MDL Number | MFCD22125192 |
| Molecular Formula | C13H11BrClNO2S |
| Molecular Weight | 360.6539 |
| SMILES | O=S(C1=CC=C(Br)C=C1)(NC2=CC=C(Cl)C(C)=C2)=O |
| Synonyms | 4-bromo-N-(4-chloro-3-methylphenyl)benzenesulfonamide,
1266466-05-0,
MFCD22125192,
ZINC80053564,
AKOS005165951,
CS-0061264,
4-Bromo-N-(4-chloro-3-methylphenyl)-benzenesulfonamide,
|
| Complexity | 390 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 358.938g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 360.65g/mol |
| Monoisotopic Mass | 358.938g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number