Base information
| Cat. No. | |
| CAS No. | 112106-91-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H11NO2 |
| Molecular Weight | 177.2 |
| Exact Mass | 177.079 |
| XLogP3 | 1.5792 |
| Mr | 52.8142 |
| PSA | 38.33 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cccc2c1NCC2 |
