5-Bromo-2-chloro-4-(trifluoromethyl)-1H-1,3-benzimidazole

• Catalog: OFC1803902364
• CAS: 1803902-36-4
• Category: Fluorinated Benzimidazoles
• Synonyms: 5-Bromo-2-chloro-4-trifluoromethyl-1H-benzimidazole
• MDL Number: MFCD28154991

• IUPAC Name: 5-bromo-2-chloro-4-(trifluoromethyl)-1H-benzimidazole
• InChI: InChI=1S/C8H3BrClF3N2/c9-3-1-2-4-6(15-7(10)14-4)5(3)8(11,12)13/h1-2H,(H,14,15)
• InChI Key: HTJIESVAVPAMJV-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC(=C(C2=C1NC(=N2)Cl)C(F)(F)F)Br

• Molecular Formula: C8H3BrClF3N2
• Molecular Weight: 299.48

• XLogP3-AA: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 297.91202 g/mol
• Monoisotopic Mass: 297.91202 g/mol
• Topological Polar Surface Area: 28.7Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 251