| CAS Number | 1094713-95-7 |
| Catalog Number | AG01B2VK |
| Chemical Name | 2-[(dimethylamino)methyl]benzene-1-sulfonamide |
| IUPAC Name | 2-[(dimethylamino)methyl]benzenesulfonamide |
| InChI | InChI=1S/C9H14N2O2S/c1-11(2)7-8-5-3-4-6-9(8)14(10,12)13/h3-6H,7H2,1-2H3,(H2,10,12,13) |
| InChI Key | NRAOBJOUJXNRHS-UHFFFAOYSA-N |
| MDL Number | MFCD11650781 |
| Molecular Formula | C9H14N2O2S |
| Molecular Weight | 214.2847 |
| SMILES | CN(CC1=C(S(N)(=O)=O)C=CC=C1)C |
| Synonyms | 2-[(dimethylamino)methyl]benzene-1-sulfonamide,
1094713-95-7,
SCHEMBL3363463,
ZINC36984594,
AKOS009386346,
2-((dimethylamino)methyl)benzenesulfonamide,
Z2215791231,
|
| Complexity | 269 |
| 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 | 0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number