Base information
| Cat. No. | |
| CAS No. | 570416-36-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C7H10N2O |
| Molecular Weight | 138.167 |
| Exact Mass | 138.079 |
| XLogP3 | 0.8933 |
| Mr | 39.4377 |
| PSA | 45.75 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 20 |
| Ring number | 1 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CC(c1ccc(=O)[nH]n1)C |
