Base information
| Cat. No. | |
| CAS No. | 28166-41-8 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H7NO3 |
| Molecular Weight | 189.167 |
| Exact Mass | 189.043 |
| XLogP3 | 1.38378 |
| Mr | 49.6908 |
| PSA | 81.32 |
| Sequence | - |
| Atom number | 21 |
| Bond number | 21 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#CC(=Cc1ccc(cc1)O)C(=O)O |
