4-Nitro-6-(trifluoromethyl)-2,1,3-benzoxadiazol-1-ium-1-olate
4-nitro-1-oxido-6-(trifluoromethyl)-2,1,3-benzoxadiazol-1-ium
Also Known As: 4-nitro-6-(trifluoromethyl)-2,1,3-benzoxadiazol-1-ium-1-olate|4-nitro-6-trifluoromethylbenzofuroxan|J1.707.739B|D-5180|4-Nitro-6-(trifluoromethyl)benzofurazane 1-oxide|4-nitro-1-oxido-6-(trifluoromethyl)-2,1,3-benzoxadiazol-1-ium|4-nitro-6-(trifluoromethyl)benzo[c]1,2,5-oxadiazol-1-ol|1-Oxylato-4-nitro-6-(trifluoromethyl)-2,1,3-benzoxadiazole-1-ium
| Molecular Formula | C7H2F3N3O4 |
|---|---|
| Molecular Weight | 248.99974 g/mol |
| LogP | 1.3882 |
| Topological Polar Surface Area | 96.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.99974 |
| Monoisotopic Mass | 248.99974 |
| Heavy Atoms | 17 |
| Complexity | 606.1651 |
Chemical Identifiers
| CAS Number | 36389-01-2 |
|---|---|
| SMILES | C1=C(C=C(C2=NO[N+](=C21)[O-])[N+](=O)[O-])C(F)(F)F |
Product Overview
4-Nitro-6-(trifluoromethyl)-2,1,3-benzoxadiazol-1-ium-1-olate (CAS 36389-01-2), with molecular formula C7H2F3N3O4 and molecular weight 248.99974 g/mol. IUPAC: 4-nitro-1-oxido-6-(trifluoromethyl)-2,1,3-benzoxadiazol-1-ium.
4-Nitro-6-(trifluoromethyl)-2,1,3-benzoxadiazol-1-ium-1-olate is a custom synthesis product. We offer services from milligram to kilogram scale.
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