Base information
| Cat. No. | |
| CAS No. | 33142-23-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H7NO3 |
| Molecular Weight | 141.125 |
| Exact Mass | 141.043 |
| XLogP3 | -0.11182 |
| Mr | 32.19 |
| PSA | 67.16 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 16 |
| Ring number | 0 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)C(C#N)C=O |
