7-methyl-4-nitro-1-oxo-2,1,3lambda~5~-benzoxadiazole
Chemical Structure Depiction of
7-methyl-4-nitro-1-oxo-2,1,3lambda~5~-benzoxadiazole
7-methyl-4-nitro-1-oxo-2,1,3lambda~5~-benzoxadiazole
Compound characteristics
| Compound ID: | 4102-0100 |
| Compound Name: | 7-methyl-4-nitro-1-oxo-2,1,3lambda~5~-benzoxadiazole |
| Molecular Weight: | 195.13 |
| Molecular Formula: | C7 H5 N3 O4 |
| Smiles: | Cc1ccc(c2c1[n+]([O-])on2)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.5228 |
| logD: | 1.5228 |
| logSw: | -1.8503 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.587 |
| InChI Key: | GYSYGOWOTQKBTH-UHFFFAOYSA-N |