| CAS Number | 1094222-84-0 |
| Catalog Number | AG01B186 |
| Chemical Name | N-ethyl-N-(2-methylphenyl)aminosulfonamide |
| IUPAC Name | 1-[ethyl(sulfamoyl)amino]-2-methylbenzene |
| InChI | InChI=1S/C9H14N2O2S/c1-3-11(14(10,12)13)9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3,(H2,10,12,13) |
| InChI Key | FQSFEHDMMKCMAY-UHFFFAOYSA-N |
| MDL Number | MFCD11205206 |
| Molecular Formula | C9H14N2O2S |
| Molecular Weight | 214.2847 |
| SMILES | CCN(S(N)(=O)=O)C1=C(C)C=CC=C1 |
| Synonyms | N-ethyl-N-(2-methylphenyl)aminosulfonamide,
1094222-84-0,
ZINC36924398,
AKOS034558451,
MCULE-5063045177,
NE23729,
Z740196564,
|
| Complexity | 271 |
| 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 | 1.1 |
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Certificate of Analysis
Lot Number