Base information
| Cat. No. | |
| CAS No. | 13745-58-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H8N2O2 |
| Molecular Weight | 140.14 |
| Exact Mass | 140.059 |
| XLogP3 | 0.4267 |
| Mr | 35.4143 |
| PSA | 55.12 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1c(C)cnn1C |
