Base information
| Cat. No. | |
| CAS No. | 488-05-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H14O2 |
| Molecular Weight | 166.217 |
| Exact Mass | 166.099 |
| XLogP3 | 2.8168 |
| Mr | 48.2895 |
| PSA | 30.21 |
| Sequence | - |
| Atom number | 26 |
| Bond number | 26 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CC(CC(=O)c1occc1C)C |
