Base information
| Cat. No. | |
| CAS No. | 33791-58-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H16O2 |
| Molecular Weight | 204.265 |
| Exact Mass | 204.115 |
| XLogP3 | 2.3163 |
| Mr | 58.6 |
| PSA | 26.3 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 33 |
| Ring number | 3 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | C=CC(=O)OC1C[C@H]2C[C@@H]1[C@@H]1[C@H]2C=CC1 |
