Base information
| Cat. No. | |
| CAS No. | 850175-21-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H18O2S |
| Molecular Weight | 238.346 |
| Exact Mass | 238.103 |
| XLogP3 | 3.3487 |
| Mr | 68.608 |
| PSA | 51.6 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 34 |
| Ring number | 1 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)CCSc1c(C)cccc1C |
