HuagongsheHuagongshe Chemistry Print Report · For research reference only
N-methyl-4-nitro-2,1,3-benzoxadiazol-5-amine
Identifiers & Physical Properties
| CAS No. | 18378-30-8 |
|---|---|
| Molecular formula | C7H6N4O3 |
| Average molar mass | 194.15 g/mol |
| Monoisotopic mass | 194.04399007 g/mol |
| SMILES | CNc1ccc2nonc2c1[N+](=O)[O-] |
| InChIKey | XWKCLHMIQVWXPI-UHFFFAOYSA-N |
| PubChem CID | 2836613 |
| DTXSID | DTXSID801259270 |
Chemical & Physical Properties
| XLogP | 1.5 |
|---|---|
| Topological polar surface area | 96.8 |
| Hydrogen bond donors | 1 |
| Hydrogen bond acceptors | 6 |
| Rotatable bonds | 1 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 231 |