Base information
| Cat. No. | |
| CAS No. | 46053-56-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H10N2O2 |
| Molecular Weight | 166.177 |
| Exact Mass | 166.074 |
| XLogP3 | 0.8974 |
| Mr | 43.0309 |
| PSA | 65.21 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | NCCOC(=O)c1cccnc1 |
