![5-{[4-(Trifluoromethoxy)anilino]carbonyl}-2,1,3-benzoxadiazol-1-ium-1-olate structure](/static/products/6802/680211-77-2.webp)
5-{[4-(Trifluoromethoxy)anilino]carbonyl}-2,1,3-benzoxadiazol-1-ium-1-olate
1-oxido-N-[4-(trifluoromethoxy)phenyl]-2,1,3-benzoxadiazol-1-ium-5-carboxamide
Also Known As: 5-{[4-(trifluoromethoxy)anilino]carbonyl}-2,1,3-benzoxadiazol-1-ium-1-olate|1-oxido-N-[4-(trifluoromethoxy)phenyl]-2,1,3-benzoxadiazol-1-ium-5-carboxamide|SR-01000852406-2|N-[4-(trifluoromethoxy)phenyl]-2,1,3-benzoxadiazole-5-carboxamide 1-oxide|1-Oxo-N-[4-(trifluoromethoxy)phenyl]-2,1lambda~5~,3-benzoxadiazole-5-carboxamide|5-([4-(TRIFLUOROMETHOXY)ANILINO]CARBONYL)-2,1,3-BENZOXADIAZOL-1-IUM-1-OLATE|5-[(4-(Trifluoromethoxy)anilino]carbonyl)-2,1,3-benzoxadizol-1-ium-1-oxide|5-{[4-(trifluoromethoxy)phenyl]carbamoyl}-2,1,3-benzoxadiazol-1-ium-1-olate
| Molecular Formula | C14H8F3N3O4 |
|---|---|
| Molecular Weight | 339.0467 g/mol |
| LogP | 2.6121 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 339.0467 |
| Monoisotopic Mass | 339.0467 |
| Heavy Atoms | 24 |
| Complexity | 890.4112 |
Chemical Identifiers
| CAS Number | 680211-77-2 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C2=CC3=NO[N+](=C3C=C2)[O-])OC(F)(F)F |
Product Overview
5-{[4-(Trifluoromethoxy)anilino]carbonyl}-2,1,3-benzoxadiazol-1-ium-1-olate (CAS 680211-77-2), with molecular formula C14H8F3N3O4 and molecular weight 339.0467 g/mol. IUPAC: 1-oxido-N-[4-(trifluoromethoxy)phenyl]-2,1,3-benzoxadiazol-1-ium-5-carboxamide.