| CAS Number | 1935987-67-9 |
| Catalog Number | AG01E7M4 |
| Chemical Name | 5-Methyl-1H-pyrazole-4-sulfonamide |
| IUPAC Name | 5-methyl-1H-pyrazole-4-sulfonamide |
| InChI | InChI=1S/C4H7N3O2S/c1-3-4(2-6-7-3)10(5,8)9/h2H,1H3,(H,6,7)(H2,5,8,9) |
| InChI Key | MIMXTAARSXTZJH-UHFFFAOYSA-N |
| MDL Number | MFCD12766757 |
| Molecular Formula | C4H7N3O2S |
| Molecular Weight | 161.1823 |
| SMILES | CC1=C(S(N)(=O)=O)C=NN1 |
| Synonyms | 5-methyl-1H-pyrazole-4-sulfonamide,
1935987-67-9,
SCHEMBL20239803,
3-methyl-1H-pyrazole-4-sulfonamide,
ZINC37730507,
AKOS010134176,
Z1143370815,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 161.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 161.179g/mol |
| Monoisotopic Mass | 161.026g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 97.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number