Base information
| Cat. No. | |
| CAS No. | 2840-22-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H15NO3S |
| Molecular Weight | 217.285 |
| Exact Mass | 217.077 |
| XLogP3 | 2.549 |
| Mr | 55.7965 |
| PSA | 74.78 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 28 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(cc1)S(=O)(=O)O.CNC |
