Base information
| Cat. No. | |
| CAS No. | 173850-41-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H7NO3 |
| Molecular Weight | 141.125 |
| Exact Mass | 141.043 |
| XLogP3 | 0.8513 |
| Mr | 32.5895 |
| PSA | 52.33 |
| Sequence | - |
| Atom number | 17 |
| Bond number | 17 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CCOC(=O)c1ccno1 |
