Base information
| Cat. No. | |
| CAS No. | 716-39-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H6O3 |
| Molecular Weight | 198.174 |
| Exact Mass | 198.032 |
| XLogP3 | 2.1504 |
| Mr | 53.694 |
| PSA | 43.37 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 23 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1OC(=O)c2c1cc1ccccc1c2 |
