Base information
| Cat. No. | |
| CAS No. | 5246-57-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H11NO3S |
| Molecular Weight | 201.243 |
| Exact Mass | 201.046 |
| XLogP3 | 1.6968 |
| Mr | 49.9092 |
| PSA | 88.77 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OCCS(=O)(=O)c1cccc(c1)N |
