Base information
| Cat. No. | |
| CAS No. | 6472-58-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H9NO4S |
| Molecular Weight | 203.216 |
| Exact Mass | 203.025 |
| XLogP3 | 2.1861 |
| Mr | 47.1972 |
| PSA | 98 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1N)S(=O)(=O)O |
