Base information
| Cat. No. | |
| CAS No. | 85311-39-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12N4 |
| Molecular Weight | 176.218 |
| Exact Mass | 176.106 |
| XLogP3 | 2.5065 |
| Mr | 54.8345 |
| PSA | 80.72 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | Cc1c(C)c(N)c2c(c1N)[nH]cn2 |
