Base information
| Cat. No. | |
| CAS No. | 1368841-42-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H7NO3 |
| Molecular Weight | 141.125 |
| Exact Mass | 141.043 |
| XLogP3 | 0.6101 |
| Mr | 33.0138 |
| PSA | 63.33 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Cc1cnc(o1)CC(=O)O |
