Base information
| Cat. No. | |
| CAS No. | 31730-24-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C12H7NO3 |
| Molecular Weight | 213.189 |
| Exact Mass | 213.043 |
| XLogP3 | 0.5204 |
| Mr | 57.747 |
| PSA | 47.89 |
| Sequence | - |
| Atom number | 23 |
| Bond number | 24 |
| Ring number | 2 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | COC1=[C][C]=C([C]=[C]1)C=C1N=C(OC1=O)C |
