Base information
| Cat. No. | |
| CAS No. | 5413-60-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16O2 |
| Molecular Weight | 192.254 |
| Exact Mass | 192.115 |
| XLogP3 | 2.1502 |
| Mr | 54.267 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 32 |
| Ring number | 3 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(=O)OC1CC2CC1C1C2C=CC1 |
