Base information
| Cat. No. | |
| CAS No. | 149771-16-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H6N2O4S |
| Molecular Weight | 214.199 |
| Exact Mass | 214.005 |
| XLogP3 | 0.5949 |
| Mr | 47.6716 |
| PSA | 125.68 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CSc1ncc(c(n1)C(=O)O)C(=O)O |
