| CAS Number | 156522-10-0 |
| Catalog Number | AG01AAZ1 |
| Chemical Name | N-[2-Amino-4-(trifluoromethyl)phenyl]methanesulfonamide |
| IUPAC Name | N-[2-amino-4-(trifluoromethyl)phenyl]methanesulfonamide |
| InChI | InChI=1S/C8H9F3N2O2S/c1-16(14,15)13-7-3-2-5(4-6(7)12)8(9,10)11/h2-4,13H,12H2,1H3 |
| InChI Key | QZLFTWBTXDWEFZ-UHFFFAOYSA-N |
| MDL Number | MFCD09043473 |
| Molecular Formula | C8H9F3N2O2S |
| Molecular Weight | 254.2295 |
| SMILES | CS(=O)(NC1=CC=C(C(F)(F)F)C=C1N)=O |
| Synonyms | N-[2-amino-4-(trifluoromethyl)phenyl]methanesulfonamide,
156522-10-0,
AC1Q4GPB,
CTK7D5752,
ZINC21955271,
AKOS000127441,
MCULE-2185568877,
NE25339,
EN300-69969,
Z1263820452,
|
| Complexity | 336 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.227g/mol |
| Monoisotopic Mass | 254.034g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 80.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number