Base information
| Cat. No. | |
| CAS No. | 272437-84-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H7NO3S |
| Molecular Weight | 209.222 |
| Exact Mass | 209.015 |
| XLogP3 | 1.567 |
| Mr | 55.449 |
| PSA | 91.7 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | O=C1CSc2c(N1)cc(cc2)C(=O)O |
