Base information
| Cat. No. | |
| CAS No. | 25473-71-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C13H13NO2 |
| Molecular Weight | 215.248 |
| Exact Mass | 215.095 |
| XLogP3 | 2.2343 |
| Mr | 62.4227 |
| PSA | 42.09 |
| Sequence | - |
| Atom number | 29 |
| Bond number | 31 |
| Ring number | 3 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(c1)c1CC(=O)CCc1[nH]2 |
