6-Bromo-4-fluoro -2-(trifluoromethyl)-1H-benzimidazole

• Catalog: OFC2089920056
• CAS: 2089920-05-6
• Category: Fluorinated Benzimidazoles
• Synonyms: 5-Bromo-7-fluoro-2-(trifluoromethyl)-1H-benzo[d]imidazole
• MDL Number: MFCD28154941

• IUPAC Name: 6-bromo-4-fluoro-2-(trifluoromethyl)-1H-benzimidazole
• InChI: InChI=1S/C8H3BrF4N2/c9-3-1-4(10)6-5(2-3)14-7(15-6)8(11,12)13/h1-2H,(H,14,15)
• InChI Key: HIAMGFGWHRHLSL-UHFFFAOYSA-N
• Isomeric SMILES: C1=C(C=C(C2=C1NC(=N2)C(F)(F)F)F)Br

• Molecular Formula: C8H3BrF4N2
• Molecular Weight: 283.02

• XLogP3-AA: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 281.94157 g/mol
• Monoisotopic Mass: 281.94157 g/mol
• Topological Polar Surface Area: 28.7Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 247