Base information
| Cat. No. | |
| CAS No. | 1261726-80-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H6N2O |
| Molecular Weight | 158.157 |
| Exact Mass | 158.048 |
| XLogP3 | 1.13048 |
| Mr | 46.1132 |
| PSA | 52.89 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 19 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc2c(c1)C(=O)NC2 |
