| CAS Number | 1711413-16-9 |
| Catalog Number | AG00HZJ2(AGN-PC-0WR12M) |
| Chemical Name | 4-Bromo-2-fluoro-N-phenylbenzenesulfonamide |
| IUPAC Name | 4-bromo-2-fluoro-N-phenylbenzenesulfonamide |
| InChI | InChI=1S/C12H9BrFNO2S/c13-9-6-7-12(11(14)8-9)18(16,17)15-10-4-2-1-3-5-10/h1-8,15H |
| InChI Key | PVZFATREKMVKIL-UHFFFAOYSA-N |
| MDL Number | MFCD27824721 |
| Molecular Formula | C12H9BrFNO2S |
| Molecular Weight | 330.1728 |
| SMILES | BrC1=CC(=C(C=C1)S(=O)(=O)NC1=CC=CC=C1)F |
| Synonyms | 4-Bromo-2-fluoro-N-phenylbenzenesulfonamide,
1711413-16-9,
MFCD27824721,
ZINC96170834,
AS-40056,
CS-0060558,
|
| Complexity | 365 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 328.952g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 330.171g/mol |
| Monoisotopic Mass | 328.952g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number