Base information
| Cat. No. | |
| CAS No. | 82-57-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H10O4 |
| Molecular Weight | 230.216 |
| Exact Mass | 230.058 |
| XLogP3 | 2.8562 |
| Mr | 63.714 |
| PSA | 52.58 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 29 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1c2c(=O)cc(oc2cc2c1cco2)C |
