Base information
| Cat. No. | |
| CAS No. | 4547-45-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12O3S |
| Molecular Weight | 188.244 |
| Exact Mass | 188.051 |
| XLogP3 | 1.2193 |
| Mr | 47.532 |
| PSA | 68.67 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)C1CCCSC1=O |
