| CAS Number | 1156113-08-4 |
| Catalog Number | AG01B64S |
| Chemical Name | 4-fluoro-N-methyl-N-(propan-2-yl)benzene-1-sulfonamide |
| IUPAC Name | 4-fluoro-N-methyl-N-propan-2-ylbenzenesulfonamide |
| InChI | InChI=1S/C10H14FNO2S/c1-8(2)12(3)15(13,14)10-6-4-9(11)5-7-10/h4-8H,1-3H3 |
| InChI Key | ADPVYHYPLKBUPS-UHFFFAOYSA-N |
| MDL Number | MFCD12173536 |
| Molecular Formula | C10H14FNO2S |
| Molecular Weight | 231.2871 |
| SMILES | CC(N(S(C1=CC=C(F)C=C1)(=O)=O)C)C |
| Synonyms | 4-fluoro-N-methyl-N-(propan-2-yl)benzene-1-sulfonamide,
1156113-08-4,
SCHEMBL13035726,
ZINC35085298,
AKOS008942334,
|
| Complexity | 289 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.285g/mol |
| Monoisotopic Mass | 231.073g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 45.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number