Base information
| Cat. No. | |
| CAS No. | 700-96-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H10O2S |
| Molecular Weight | 170.229 |
| Exact Mass | 170.04 |
| XLogP3 | 1.9925 |
| Mr | 46.678 |
| PSA | 57.26 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1cc(S)ccc1OC |
