Base information
| Cat. No. | |
| CAS No. | 5317-89-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11NO3S |
| Molecular Weight | 213.254 |
| Exact Mass | 213.046 |
| XLogP3 | 2.4145 |
| Mr | 54.9062 |
| PSA | 71.62 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CC(=O)c1ccc(cc1)NS(=O)(=O)C |
