Base information
| Cat. No. | |
| CAS No. | 4439-68-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H8O5 |
| Molecular Weight | 232.189 |
| Exact Mass | 232.037 |
| XLogP3 | 1.7371 |
| Mr | 60.4068 |
| PSA | 83.81 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 27 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OCc1cc(=O)c2c(o1)cc1c(c2O)cco1 |
