Base information
| Cat. No. | |
| CAS No. | 80613-57-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H9NO4 |
| Molecular Weight | 219.193 |
| Exact Mass | 219.053 |
| XLogP3 | 1.743 |
| Mr | 58.1679 |
| PSA | 82.53 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 26 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC(=O)c1cc2cc(N)ccc2oc1=O |
