Base information
| Cat. No. | |
| CAS No. | 2591-98-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H9NO |
| Molecular Weight | 159.185 |
| Exact Mass | 159.068 |
| XLogP3 | 1.9093 |
| Mr | 48.2717 |
| PSA | 32.86 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | O=CCc1c[nH]c2c1cccc2 |
