6-Bromo-4,5-difluorobenzimidiazole

• Catalog: OFC1375068793-2
• CAS: 1375068-79-3
• Category: Fluorinated Benzimidazoles
• Synonyms: 6-bromo-4,5-difluoro-1H-benzimidazole
• Purity: 97%
• MDL Number: MFCD22205774

• IUPAC Name: 6-bromo-4,5-difluoro-1H-benzimidazole
• InChI: InChI=1S/C7H3BrF2N2/c8-3-1-4-7(12-2-11-4)6(10)5(3)9/h1-2H,(H,11,12)
• InChI Key: OCZVPWYZFGBSLI-UHFFFAOYSA-N
• Isomeric SMILES: C1=C2C(=C(C(=C1Br)F)F)N=CN2

• Molecular Formula: C7H3BrF2N2
• Molecular Weight: 233.01

• XLogP3-AA: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 231.94477 g/mol
• Monoisotopic Mass: 231.94477 g/mol
• Topological Polar Surface Area: 28.7Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 181