Base information
| Cat. No. | |
| CAS No. | 1621-56-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C16H12O3 |
| Molecular Weight | 252.265 |
| Exact Mass | 252.079 |
| XLogP3 | 3.4686 |
| Mr | 74.412 |
| PSA | 39.44 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 33 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1)occ(c2=O)c1ccccc1 |
