Base information
| Cat. No. | |
| CAS No. | 6952-13-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H7N3O2 |
| Molecular Weight | 201.181 |
| Exact Mass | 201.054 |
| XLogP3 | 2.66538 |
| Mr | 56.6427 |
| PSA | 85.4 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 23 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#CCc1c[nH]c2c1cc(cc2)[N+](=O)[O-] |
