Base information
| Cat. No. | |
| CAS No. | 177200-76-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H16O2 |
| Molecular Weight | 192.254 |
| Exact Mass | 192.115 |
| XLogP3 | 1.9757 |
| Mr | 55.3158 |
| PSA | 29.46 |
| Sequence | - |
| Atom number | 30 |
| Bond number | 31 |
| Ring number | 2 |
| Rotor number | 5 |
| Residues number | 0 |
| Canonical smiles | OCC1(CC1)COCc1ccccc1 |
