Base information
| Cat. No. | |
| CAS No. | 53020-44-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5NO2 |
| Molecular Weight | 159.141 |
| Exact Mass | 159.032 |
| XLogP3 | 2.01008 |
| Mr | 42.952 |
| PSA | 57.16 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 18 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cc2c(o1)cc(cc2)O |
