Base information
| Cat. No. | |
| CAS No. | 5779-98-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H12O4 |
| Molecular Weight | 196.2 |
| Exact Mass | 196.074 |
| XLogP3 | 1.4904 |
| Mr | 50.7055 |
| PSA | 44.76 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | COc1ccc(cc1OCOC)C=O |
