Base information
| Cat. No. | |
| CAS No. | 5247-85-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H6O2 |
| Molecular Weight | 170.164 |
| Exact Mass | 170.037 |
| XLogP3 | 2.3724 |
| Mr | 48.9065 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 21 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1Oc2c3c1cccc3ccc2 |
