Base information
| Cat. No. | |
| CAS No. | 75989-19-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C6H7NO4 |
| Molecular Weight | 157.124 |
| Exact Mass | 157.038 |
| XLogP3 | -0.0149 |
| Mr | 35.6805 |
| PSA | 83.3 |
| Sequence | - |
| Atom number | 18 |
| Bond number | 18 |
| Ring number | 1 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | OC(=O)CCc1o[nH]c(=O)c1 |
