Base information
| Cat. No. | |
| CAS No. | 70140-61-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9NO4S |
| Molecular Weight | 215.226 |
| Exact Mass | 215.025 |
| XLogP3 | 1.7646 |
| Mr | 49.297 |
| PSA | 91.85 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CNC(=O)c1ccc(cc1)S(=O)(=O)O |
