Base information
| Cat. No. | |
| CAS No. | 75890-68-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6N2O3S |
| Molecular Weight | 186.188 |
| Exact Mass | 186.01 |
| XLogP3 | 1.0474 |
| Mr | 43.5535 |
| PSA | 107.53 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=CNc1scc(n1)CC(=O)O |
