Base information
| Cat. No. | |
| CAS No. | 136521-57-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7NO2 |
| Molecular Weight | 137.136 |
| Exact Mass | 137.048 |
| XLogP3 | 1.14498 |
| Mr | 34.3578 |
| PSA | 57.16 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | Cc1ccc(o1)[C@H](C#N)O |
