3-[2-(trifluoromethyl)phenyl]-1,2,3,4-oxatriazol-3-ium-5-olate
Chemical Structure Depiction of
3-[2-(trifluoromethyl)phenyl]-1,2,3,4-oxatriazol-3-ium-5-olate
3-[2-(trifluoromethyl)phenyl]-1,2,3,4-oxatriazol-3-ium-5-olate
Compound characteristics
| Compound ID: | 8006-9875 |
| Compound Name: | 3-[2-(trifluoromethyl)phenyl]-1,2,3,4-oxatriazol-3-ium-5-olate |
| Molecular Weight: | 231.13 |
| Molecular Formula: | C8 H4 F3 N3 O2 |
| Smiles: | c1ccc(c(c1)C(F)(F)F)[n+]1nc([O-])on1 |
| Stereo: | ACHIRAL |
| logP: | 1.3684 |
| logD: | 1.3684 |
| logSw: | -1.9476 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 51.146 |
| InChI Key: | NZFBRRTXRMKWNE-UHFFFAOYSA-N |