6-Fluoro-1H-benzo[d]imidazole-2-carbaldehyde

• Catalog: OFC885280342
• CAS: 885280-34-2
• Category: Fluorinated Benzimidazoles
• Synonyms: 5-fluoro-1H-benzo[d]imidazole-2-carbaldehyde
• Purity: >95%
• MDL Number: MFCD07778419

• IUPAC Name: 6-fluoro-1H-benzimidazole-2-carbaldehyde
• InChI: InChI=1S/C8H5FN2O/c9-5-1-2-6-7(3-5)11-8(4-12)10-6/h1-4H,(H,10,11)
• InChI Key: XTQRRWMIWMTBDL-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC2=C(C=C1F)NC(=N2)C=O

• Molecular Formula: C8H5FN2O
• Molecular Weight: 164.14

• XLogP3-AA: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 164.03859095 g/mol
• Monoisotopic Mass: 164.03859095 g/mol
• Topological Polar Surface Area: 45.8Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 188