Base information
| Cat. No. | |
| CAS No. | 1017783-22-0 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H11N3 |
| Molecular Weight | 125.172 |
| Exact Mass | 125.095 |
| XLogP3 | 0.9997 |
| Mr | 35.8751 |
| PSA | 54.7 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | CC(Cc1cc[nH]n1)N |
