Base information
| Cat. No. | |
| CAS No. | 31212-13-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H8KNO3 |
| Molecular Weight | 181.231 |
| Exact Mass | 181.014 |
| XLogP3 | -0.7197 |
| Mr | 34.8589 |
| PSA | 83.22 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 16 |
| Ring number | 0 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | [O-]C(=O)C=C.NC(=O)C=C.[K+] |
