2-ethyl-5,6-dinitro-1H-benzimidazole
Chemical Structure Depiction of
2-ethyl-5,6-dinitro-1H-benzimidazole
2-ethyl-5,6-dinitro-1H-benzimidazole
Compound characteristics
| Compound ID: | 0428-0004 |
| Compound Name: | 2-ethyl-5,6-dinitro-1H-benzimidazole |
| Molecular Weight: | 236.18 |
| Molecular Formula: | C9 H8 N4 O4 |
| Smiles: | CCc1nc2cc(c(cc2[nH]1)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.2418 |
| logD: | 2.012 |
| logSw: | -2.4631 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.681 |
| InChI Key: | GPHHJHUXERLRCY-UHFFFAOYSA-N |