Base information
| Cat. No. | |
| CAS No. | 134996-50-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H8O3S |
| Molecular Weight | 196.223 |
| Exact Mass | 196.019 |
| XLogP3 | 1.8879 |
| Mr | 48.6748 |
| PSA | 62.75 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OCC1=Cc2c(S1(=O)=O)cccc2 |
