Base information
| Cat. No. | |
| CAS No. | 1039897-29-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C10H12N2O |
| Molecular Weight | 176.215 |
| Exact Mass | 176.095 |
| XLogP3 | 2.13058 |
| Mr | 49.903 |
| PSA | 45.91 |
| Sequence | - |
| Atom number | 25 |
| Bond number | 25 |
| Ring number | 1 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | N#Cc1cccnc1OC(C)(C)C |
