Base information
| Cat. No. | |
| CAS No. | 4594-71-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H9NO |
| Molecular Weight | 159.185 |
| Exact Mass | 159.068 |
| XLogP3 | 1.5385 |
| Mr | 49.47 |
| PSA | 22 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cn1ccc2c(c1=O)cccc2 |
