Base information
| Cat. No. | |
| CAS No. | 1039963-53-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H10O2S |
| Molecular Weight | 182.239 |
| Exact Mass | 182.04 |
| XLogP3 | 2.4061 |
| Mr | 50.207 |
| PSA | 57.26 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CC(c1ccc2c(c1)OCO2)S |
