Base information
| Cat. No. | |
| CAS No. | 13679-61-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H6O2S |
| Molecular Weight | 142.176 |
| Exact Mass | 142.009 |
| XLogP3 | 1.7828 |
| Mr | 36.4935 |
| PSA | 55.51 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 15 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CSC(=O)c1ccco1 |
