| CAS Number | 701933-54-2 |
| Catalog Number | AG019F09 |
| Chemical Name | 4-bromo-N-(2,6-difluorophenyl)benzene-1-sulfonamide |
| IUPAC Name | 4-bromo-N-(2,6-difluorophenyl)benzenesulfonamide |
| InChI | InChI=1S/C12H8BrF2NO2S/c13-8-4-6-9(7-5-8)19(17,18)16-12-10(14)2-1-3-11(12)15/h1-7,16H |
| InChI Key | GHFNAVYZBQOPFF-UHFFFAOYSA-N |
| MDL Number | MFCD04402513 |
| Molecular Formula | C12H8BrF2NO2S |
| Molecular Weight | 348.1632 |
| SMILES | Fc1cccc(F)c1NS(=O)(=O)c1ccc(Br)cc1 |
| Synonyms | 4-bromo-N-(2,6-difluorophenyl)benzenesulfonamide,
701933-54-2,
AC1LJ812,
ZINC609357,
MFCD04402513,
STL255082,
AKOS000950941,
MCULE-3042111489,
SC-56515,
CS-0060308,
ST51045197,
(2,6-difluorophenyl)[(4-bromophenyl)sulfonyl]amine,
4-Bromo-N-(2,6-difluoro-phenyl)-benzenesulfonamide,
4-Bromo-N-(2,6-difluorophenyl)-benzenesulfonamide,
CID970063,
ZINC00609357,
|
| Complexity | 383 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 346.943g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 348.162g/mol |
| Monoisotopic Mass | 346.943g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number