Base information
| Cat. No. | |
| CAS No. | 76931-93-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9NO5S |
| Molecular Weight | 231.226 |
| Exact Mass | 231.02 |
| XLogP3 | -0.1888 |
| Mr | 54.743 |
| PSA | 106.05 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | O=C(ON1C(=O)CCC1=O)CSC(=O)C |
