Base information
| Cat. No. | |
| CAS No. | 1082041-51-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5N3O2 |
| Molecular Weight | 187.155 |
| Exact Mass | 187.038 |
| XLogP3 | 2.47098 |
| Mr | 51.8357 |
| PSA | 85.4 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cc2[nH]ccc2c(c1)[N+](=O)[O-] |