| CAS Number | 313981-48-5 |
| Catalog Number | AG019EWP(AGN-PC-0WG464) |
| Chemical Name | N-(2-Chloro-5-(trifluoromethyl)phenyl)-4-methoxybenzenesulfonamide |
| IUPAC Name | N-[2-chloro-5-(trifluoromethyl)phenyl]-4-methoxybenzenesulfonamide |
| InChI | InChI=1S/C14H11ClF3NO3S/c1-22-10-3-5-11(6-4-10)23(20,21)19-13-8-9(14(16,17)18)2-7-12(13)15/h2-8,19H,1H3 |
| InChI Key | WJCLVVBGNLNOPR-UHFFFAOYSA-N |
| MDL Number | MFCD00784315 |
| Molecular Formula | C14H11ClF3NO3S |
| Molecular Weight | 365.7552 |
| SMILES | COc1ccc(cc1)S(=O)(=O)Nc1cc(ccc1Cl)C(F)(F)F |
| Synonyms | 313981-48-5,
N-[2-chloro-5-(trifluoromethyl)phenyl]-4-methoxybenzenesulfonamide,
N-(2-Chloro-5-(trifluoromethyl)phenyl)-4-methoxybenzenesulfonamide,
AC1LLJNE,
C14H11ClF3NO3S,
ZINC753310,
MFCD00784315,
STK095170,
AKOS001603943,
MCULE-5237757989,
CS-0038267,
ST50682667,
AB00082314-01,
SR-01000406980,
SR-01000406980-1,
[2-chloro-5-(trifluoromethyl)phenyl][(4-methoxyphenyl)sulfonyl]amine,
ZINC00753310,
CID1068506,
|
| Complexity | 487 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 365.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 365.751g/mol |
| Monoisotopic Mass | 365.01g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 63.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number