Base information
| Cat. No. | |
| CAS No. | 7423-55-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7NO4 |
| Molecular Weight | 169.135 |
| Exact Mass | 169.038 |
| XLogP3 | -0.676 |
| Mr | 42.1578 |
| PSA | 74.68 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 19 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCN1C(=O)C=CC1=O |
