Base information
| Cat. No. | |
| CAS No. | 874-21-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H7NaO3 |
| Molecular Weight | 162.118 |
| Exact Mass | 162.029 |
| XLogP3 | -0.7284 |
| Mr | 33.2045 |
| PSA | 57.2 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | [O-]C(=O)C1CCC(=O)C1=C.[Na+] |
