Base information
| Cat. No. | |
| CAS No. | 17216-08-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H12O2 |
| Molecular Weight | 188.222 |
| Exact Mass | 188.084 |
| XLogP3 | 2.0207 |
| Mr | 54.1095 |
| PSA | 34.14 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 27 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CC(=O)C1CCc2c(C1=O)cccc2 |