| CAS Number | 210918-06-2 |
| Catalog Number | AG00I416(AGN-PC-0L1IBZ) |
| Chemical Name | 4-(Dimethylsulfamoyl)benzamide |
| IUPAC Name | 4-(dimethylsulfamoyl)benzamide |
| InChI | InChI=1S/C9H12N2O3S/c1-11(2)15(13,14)8-5-3-7(4-6-8)9(10)12/h3-6H,1-2H3,(H2,10,12) |
| InChI Key | DBEOFOZTDBYWAT-UHFFFAOYSA-N |
| MDL Number | MFCD01535993 |
| Molecular Formula | C9H12N2O3S |
| Molecular Weight | 228.2682 |
| SMILES | CN(S(=O)(=O)c1ccc(cc1)C(=O)N)C |
| Synonyms | 4-(dimethylsulfamoyl)benzamide,
210918-06-2,
4-[(dimethylamino)sulfonyl]benzamide,
AC1MYD1I,
Oprea1_716381,
IFLab1_000137,
SCHEMBL4639473,
HMS1412G05,
4-(N,N-dimethylsulfamoyl)benzamide,
ZINC1506057,
AKOS000114261,
MCULE-2468886059,
IDI1_008356,
EU-0034085,
SR-01000394604,
SR-01000394604-1,
Z33545306,
F0012-0468,
ZINC01506057,
CID3879890,
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| Complexity | 324 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.057g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.266g/mol |
| Monoisotopic Mass | 228.057g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 88.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number