Base information
| Cat. No. | |
| CAS No. | 85896-59-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H8O5 |
| Molecular Weight | 220.178 |
| Exact Mass | 220.037 |
| XLogP3 | 1.0517 |
| Mr | 55.0781 |
| PSA | 91.67 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 24 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | O=C(C(=O)O)C=Cc1ccccc1C(=O)O |
