5-Bromo-2-(difluoromethyl)-1H-benzimidazole

• Catalog: OFC1256956703
• CAS: 1256956-70-3
• Category: Fluorinated Benzimidazoles
• Synonyms: 5-bromo-2-(difluoromethyl)-1H-1,3-benzodiazole
• MDL Number: MFCD20403496

• IUPAC Name: 6-bromo-2-(difluoromethyl)-1H-benzimidazole
• InChI: InChI=1S/C8H5BrF2N2/c9-4-1-2-5-6(3-4)13-8(12-5)7(10)11/h1-3,7H,(H,12,13)
• InChI Key: DNVWMFVLIONESY-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC2=C(C=C1Br)NC(=N2)C(F)F
• EC Number: 872-741-5

• Molecular Formula: C8H5BrF2N2
• Molecular Weight: 247.04

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 245.96042 g/mol
• Monoisotopic Mass: 245.96042 g/mol
• Topological Polar Surface Area: 28.7Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 191