| CAS Number | 1040070-45-8 |
| Catalog Number | AG01B4GD |
| Chemical Name | N-(4-aminophenyl)-N-methylethane-1-sulfonamide |
| IUPAC Name | N-(4-aminophenyl)-N-methylethanesulfonamide |
| InChI | InChI=1S/C9H14N2O2S/c1-3-14(12,13)11(2)9-6-4-8(10)5-7-9/h4-7H,3,10H2,1-2H3 |
| InChI Key | ORIHHWFKHNUYDC-UHFFFAOYSA-N |
| MDL Number | MFCD11184918 |
| Molecular Formula | C9H14N2O2S |
| Molecular Weight | 214.2847 |
| SMILES | CCS(N(C1=CC=C(N)C=C1)C)(=O)=O |
| Synonyms | N-(4-aminophenyl)-N-methylethane-1-sulfonamide,
1040070-45-8,
ZINC20374291,
|
| Complexity | 263 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.283g/mol |
| Monoisotopic Mass | 214.078g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number