Base information
| Cat. No. | |
| CAS No. | 1334331-27-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9H5N3O2 |
| Molecular Weight | 187.155 |
| Exact Mass | 187.038 |
| XLogP3 | 0.08808 |
| Mr | 49.9044 |
| PSA | 89.51 |
| Sequence | - |
| Atom number | 19 |
| Bond number | 20 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#Cc1ccc2c(c1)c(=O)[nH]c(=O)[nH]2 |
