Base information
| Cat. No. | |
| CAS No. | 21139-92-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H9N3O2 |
| Molecular Weight | 167.165 |
| Exact Mass | 167.069 |
| XLogP3 | -0.4407 |
| Mr | 47.5831 |
| PSA | 77.75 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 22 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=c1[nH]c(=O)[nH]c2c1CCCN2 |
