Base information
| Cat. No. | |
| CAS No. | 230648-45-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H11NO2 |
| Molecular Weight | 165.189 |
| Exact Mass | 165.079 |
| XLogP3 | 1.2417 |
| Mr | 46.9655 |
| PSA | 39.07 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 23 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=Cc1ccc(=O)n(c1)C(C)C |
