| CAS Number | 1179901-00-8 |
| Catalog Number | AG00HECN(AGN-PC-0WNOCO) |
| Chemical Name | N,N-Dimethyl-1H-pyrazole-4-sulfonamide |
| IUPAC Name | N,N-dimethyl-1H-pyrazole-4-sulfonamide |
| InChI | InChI=1S/C5H9N3O2S/c1-8(2)11(9,10)5-3-6-7-4-5/h3-4H,1-2H3,(H,6,7) |
| InChI Key | HEIPZBCMZXCIPT-UHFFFAOYSA-N |
| MDL Number | MFCD12806205 |
| Molecular Formula | C5H9N3O2S |
| Molecular Weight | 175.2089 |
| SMILES | O=S(C1=CNN=C1)(N(C)C)=O |
| Synonyms | N,N-dimethyl-1H-pyrazole-4-sulfonamide,
1179901-00-8,
SCHEMBL4760210,
ZINC37744656,
AKOS010139514,
NE25021,
1H-Pyrazole-4-sulfonamide, N,N-dimethyl-,
EN300-82610,
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| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 175.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 175.206g/mol |
| Monoisotopic Mass | 175.042g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 74.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
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Certificate of Analysis
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