5-Bromo-6,7-difluoro-1,2-dimethyl-1,3-benzodiazole

• Catalog: OFC1393442437
• CAS: 1393442-43-7
• Category: Fluorinated Benzimidazoles
• Synonyms: 5-bromo-6,7-difluoro-1,2-dimethylbenzimidazole
• Purity: >95%
• MDL Number: MFCD22383708

• IUPAC Name: 5-bromo-6,7-difluoro-1,2-dimethylbenzimidazole
• InChI: InChI=1S/C9H7BrF2N2/c1-4-13-6-3-5(10)7(11)8(12)9(6)14(4)2/h3H,1-2H3
• InChI Key: NFTZXGHDKCPZIG-UHFFFAOYSA-N
• Isomeric SMILES: CC1=NC2=CC(=C(C(=C2N1C)F)F)Br

• Molecular Formula: C9H7BrF2N2
• Molecular Weight: 261.07

• XLogP3-AA: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 259.97607 g/mol
• Monoisotopic Mass: 259.97607 g/mol
• Topological Polar Surface Area: 17.8Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 229