Base information
| Cat. No. | |
| CAS No. | 144689-94-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H18N2O4 |
| Molecular Weight | 254.282 |
| Exact Mass | 254.127 |
| XLogP3 | 1.7156 |
| Mr | 65.3407 |
| PSA | 81.28 |
| Sequence | - |
| Atom number | 36 |
| Bond number | 36 |
| Ring number | 1 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | CCCc1nc(c([nH]1)C(=O)OCC)C(=O)OCC |
