Base information
| Cat. No. | |
| CAS No. | 1029721-02-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7N3O3 |
| Molecular Weight | 181.149 |
| Exact Mass | 181.049 |
| XLogP3 | -0.3465 |
| Mr | 45.2455 |
| PSA | 84.22 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1nn2c(c1)C(=O)NCC2 |
