Base information
| Cat. No. | |
| CAS No. | 81944-09-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H14O2 |
| Molecular Weight | 190.238 |
| Exact Mass | 190.099 |
| XLogP3 | 2.8738 |
| Mr | 55.433 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 28 |
| Bond number | 29 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CCC/C=C/1\OC(=O)C2=C1CCC=C2 |
