Base information
| Cat. No. | |
| CAS No. | 72835-26-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C8H9NO4 |
| Molecular Weight | 183.161 |
| Exact Mass | 183.053 |
| XLogP3 | -0.24 |
| Mr | 46.478 |
| PSA | 63.68 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 22 |
| Ring number | 1 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCC(=O)OCN1C(=O)C=CC1=O |
