5-Fluoro-1-methyl-1H-benzo[d]imidazol-2(3H)-one

• Catalog: OFC401567111
• CAS: 401567-11-1
• Category: Fluorinated Benzimidazoles
• Synonyms: 5-fluoro-1-methyl-1H-benzimidazol-2-ol
• Purity: 97%

• IUPAC Name: 6-fluoro-3-methyl-1H-benzimidazol-2-one
• InChI: InChI=1S/C8H7FN2O/c1-11-7-3-2-5(9)4-6(7)10-8(11)12/h2-4H,1H3,(H,10,12)
• InChI Key: KUDXFSXOKPNJAF-UHFFFAOYSA-N
• Isomeric SMILES: CN1C2=C(C=C(C=C2)F)NC1=O

• Molecular Formula: C8H7FN2O
• Molecular Weight: 166.15

• XLogP3-AA: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 166.05424101 g/mol
• Monoisotopic Mass: 166.05424101 g/mol
• Topological Polar Surface Area: 32.3Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 209