Base information
| Cat. No. | |
| CAS No. | 54252-56-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H12N2O |
| Molecular Weight | 164.204 |
| Exact Mass | 164.095 |
| XLogP3 | 1.6565 |
| Mr | 50.5751 |
| PSA | 47.28 |
| Sequence | - |
| Atom number | 24 |
| Bond number | 25 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | NCC1COc2c(N1)cccc2 |
