Base information
| Cat. No. | |
| CAS No. | 46049-49-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11NO2 |
| Molecular Weight | 165.189 |
| Exact Mass | 165.079 |
| XLogP3 | 1.4854 |
| Mr | 44.8264 |
| PSA | 44.48 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NC[C@H]1COc2c(O1)cccc2 |
