5-Chloro-6-fluoro-1,3-dihydro-2H-benzimidazol-2-one

• Catalog: OFC1075753251
• CAS: 1075753-25-1
• Category: Fluorinated Benzimidazoles
• Synonyms: 5-chloro-6-fluoro-2,3-dihydro-1H-1,3-benzodiazol-2-one
• Purity: 95%
• MDL Number: MFCD12963765

• IUPAC Name: 5-chloro-6-fluoro-1,3-dihydrobenzimidazol-2-one
• InChI: InChI=1S/C7H4ClFN2O/c8-3-1-5-6(2-4(3)9)11-7(12)10-5/h1-2H,(H2,10,11,12)
• InChI Key: MLLYPEORWDUMKB-UHFFFAOYSA-N
• Isomeric SMILES: C1=C2C(=CC(=C1F)Cl)NC(=O)N2
• EC Number: 869-684-3

• Molecular Formula: C7H4ClFN2O
• Molecular Weight: 186.57
• Storage: Sealed in dry, room temperature

• XLogP3-AA: 1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 185.9996186 g/mol
• Monoisotopic Mass: 185.9996186 g/mol
• Topological Polar Surface Area: 41.1Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 214