Base information
| Cat. No. | |
| CAS No. | 4452-06-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H10O |
| Molecular Weight | 182.218 |
| Exact Mass | 182.073 |
| XLogP3 | 3.2085 |
| Mr | 58.4755 |
| PSA | 17.07 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | C=CC(=O)c1ccc2c(c1)cccc2 |
