Base information
| Cat. No. | |
| CAS No. | 1228600-91-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H10N2O2 |
| Molecular Weight | 178.188 |
| Exact Mass | 178.074 |
| XLogP3 | 0.7049 |
| Mr | 50.4922 |
| PSA | 51.22 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | COc1ccc2c(n1)CCNC2=O |
