Base information
| Cat. No. | |
| CAS No. | 106531-52-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H5NO2 |
| Molecular Weight | 135.12 |
| Exact Mass | 135.032 |
| XLogP3 | 0.6567 |
| Mr | 34.0025 |
| PSA | 39.19 |
| Sequence | - |
| Atom number | 15 |
| Bond number | 16 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1COc2c1ccnc2 |
