Base information
| Cat. No. | |
| CAS No. | 117621-06-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12O5 |
| Molecular Weight | 236.221 |
| Exact Mass | 236.068 |
| XLogP3 | 1.384 |
| Mr | 58.0708 |
| PSA | 72.83 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 30 |
| Ring number | 2 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1ccccc1C1OC(=O)CC1C(=O)O |
