AC1NRJJ5 structure

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

CAS: 7167-31-9
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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