Base information
| Cat. No. | |
| CAS No. | 5653-65-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H14O3 |
| Molecular Weight | 182.216 |
| Exact Mass | 182.094 |
| XLogP3 | 1.7571 |
| Mr | 50.3608 |
| PSA | 38.69 |
| Sequence | - |
| Atom number | 27 |
| Bond number | 27 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | COc1cc(ccc1OC)C(O)C |
