6-nitro-1,2,3-benzotriazin-4(3H)-one
Chemical Structure Depiction of
6-nitro-1,2,3-benzotriazin-4(3H)-one
6-nitro-1,2,3-benzotriazin-4(3H)-one
Compound characteristics
| Compound ID: | 8019-7807 |
| Compound Name: | 6-nitro-1,2,3-benzotriazin-4(3H)-one |
| Molecular Weight: | 192.13 |
| Molecular Formula: | C7 H4 N4 O3 |
| Smiles: | c1cc2c(cc1[N+]([O-])=O)C(NN=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7512 |
| logD: | 0.1358 |
| logSw: | -2.4305 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.418 |
| InChI Key: | HFYBDBPOKYEMJB-UHFFFAOYSA-N |