Base information
| Cat. No. | |
| CAS No. | 1369496-50-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H3NO3 |
| Molecular Weight | 137.093 |
| Exact Mass | 137.011 |
| XLogP3 | 0.84948 |
| Mr | 30.3823 |
| PSA | 74.23 |
| Sequence | - |
| Atom number | 13 |
| Bond number | 13 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | N#Cc1coc(c1)C(=O)O |
