Base information
| Cat. No. | |
| CAS No. | 129425-81-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C14H14O5S |
| Molecular Weight | 294.323 |
| Exact Mass | 294.056 |
| XLogP3 | 2.966 |
| Mr | 76.3893 |
| PSA | 101.07 |
| Sequence | - |
| Atom number | 34 |
| Bond number | 35 |
| Ring number | 2 |
| Rotor number | 6 |
| Residues number | 0 |
| Canonical smiles | COc1cc2sc(cc2cc1OC)C(=O)CCC(=O)O |
