Base information
| Cat. No. | |
| CAS No. | 2088458-39-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H12N2O3 |
| Molecular Weight | 184.192 |
| Exact Mass | 184.085 |
| XLogP3 | 0.9596 |
| Mr | 47.2547 |
| PSA | 64.09 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | O=C(n1ccc(=O)[nH]1)OC(C)(C)C |
