2-(Chloromethyl)-5,6-difluoro-1H-benzimidazole

• Catalog: OFC847615285
• CAS: 847615-28-5
• Category: Fluorinated Benzimidazoles
• Synonyms: 2-(Chloromethyl)-5,6-difluorobenzimidazole
• MDL Number: MFCD09802112

• IUPAC Name: 2-(chloromethyl)-5,6-difluoro-1H-benzimidazole
• InChI: InChI=1S/C8H5ClF2N2/c9-3-8-12-6-1-4(10)5(11)2-7(6)13-8/h1-2H,3H2,(H,12,13)
• InChI Key: XKSUDTNRLIXEFE-UHFFFAOYSA-N
• Isomeric SMILES: C1=C2C(=CC(=C1F)F)N=C(N2)CCl

• Molecular Formula: C8H5ClF2N2
• Molecular Weight: 202.59

• XLogP3-AA: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 202.0109322 g/mol
• Monoisotopic Mass: 202.0109322 g/mol
• Topological Polar Surface Area: 28.7Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 193