Base information
| Cat. No. | |
| CAS No. | 83071-67-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12O4 |
| Molecular Weight | 220.221 |
| Exact Mass | 220.074 |
| XLogP3 | 1.8326 |
| Mr | 59.531 |
| PSA | 52.6 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 28 |
| Ring number | 1 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | O=C/C=C/c1ccc(c(c1)OC)OC(=O)C |
