Base information
| Cat. No. | |
| CAS No. | 171777-66-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7HD4NO4 |
| Molecular Weight | 171.144 |
| Exact Mass | 171.047 |
| XLogP3 | 1.8162 |
| Mr | 42.2233 |
| PSA | 83.12 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | [O-][N+](=O)c1c([2H])c([2H])c(c(c1[2H])[2H])C(=O)O |
