AC1NRJJ5
4-(2,3-dimethylphenyl)-3-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-1H-1,2,4-triazole-5-thione
Also Known As: 4-(2,3-dimethylphenyl)-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol|4-(2,3-dimethylphenyl)-3-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-1H-1,2,4-triazole-5-thione|4-(2,3-Dimethylphenyl)-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione|3H-1,2,4-Triazole-3-thione, 4-(2,3-dimethylphenyl)-2,4-dihydro-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-|4-(2,3-dimethylphenyl)-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-2H-1,2,4-triazole-3-thione|4-(2,3-DIMETHYLPHENYL)-5-[3-(1,1,2,2-TETRAFLUOROETHOXY)PHENYL]-4H-1,2,4-TRIAZOL-3-YLHYDROSULFIDE
| Molecular Formula | C18H15F4N3OS |
|---|---|
| Molecular Weight | 397.0872 g/mol |
| LogP | 5.45043 |
| Topological Polar Surface Area | 42.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 397.0872 |
| Monoisotopic Mass | 397.0872 |
| Heavy Atoms | 27 |
| Complexity | 1029.4414 |
Chemical Identifiers
| CAS Number | 7167-31-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2C(=NNC2=S)C3=CC(=CC=C3)OC(C(F)F)(F)F)C |
Product Overview
AC1NRJJ5 (CAS 7167-31-9), with molecular formula C18H15F4N3OS and molecular weight 397.0872 g/mol. IUPAC: 4-(2,3-dimethylphenyl)-3-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-1H-1,2,4-triazole-5-thione.
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