4,4-Dinitro-4,5,6,7-tetrahydro-2,1,3-benzoxadiazole 1-oxide
4,4-dinitro-1-oxido-6,7-dihydro-5H-2,1,3-benzoxadiazol-1-ium
Also Known As: Oprea1_596896|4,4-Dinitro-4,5,6,7-tetrahydro-2,1,3-benzoxadiazole 1-oxide|BAS 00318845|AG-690/11351337|4,4-dinitro-1-oxido-6,7-dihydro-5H-2,1,3-benzoxadiazol-1-ium|4,4-Dinitro-4,5,6,7-tetrahydro-benzo[1,2,5]oxadiazole 1-oxide|4,4-dinitro-4,5,6,7-tetrahydrobenzo[1,2-c]1,2,5-oxadiazol-1-ol|4,4-dinitro-4,5,6,7-tetrahydrobenzo[c][1,2,5]oxadiazole 1-oxide
| Molecular Formula | C6H6N4O6 |
|---|---|
| Molecular Weight | 230.02873 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 230.02873 |
| Monoisotopic Mass | 230.02873 |
| Heavy Atoms | 16 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 330982-46-2 |
|---|---|
| SMILES | C1CC2=[N+](ON=C2C(C1)([N+](=O)[O-])[N+](=O)[O-])[O-] |
| InChIKey | HJQFXTCWLYBUIV-UHFFFAOYSA-N |
Product Overview
4,4-Dinitro-4,5,6,7-tetrahydro-2,1,3-benzoxadiazole 1-oxide (CAS 330982-46-2), with molecular formula C6H6N4O6 and molecular weight 230.02873 g/mol. IUPAC: 4,4-dinitro-1-oxido-6,7-dihydro-5H-2,1,3-benzoxadiazol-1-ium.
4,4-Dinitro-4,5,6,7-tetrahydro-2,1,3-benzoxadiazole 1-oxide is a custom synthesis product. We offer services from milligram to kilogram scale.
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