4,5,6,7-Tetrafluoro-1H-indole-3-carbaldehyde

• Catalog: OFC30683386-2
• CAS: 30683-38-6
• Category: Fluorinated Indoles
• Synonyms: 1H-Indole-3-carboxaldehyde, 4,5,6,7-tetrafluoro-
• Purity: >95%
• MDL Number: MFCD00236718

• IUPAC Name: 4,5,6,7-tetrafluoro-1H-indole-3-carbaldehyde
• InChI: InChI=1S/C9H3F4NO/c10-5-4-3(2-15)1-14-9(4)8(13)7(12)6(5)11/h1-2,14H
• InChI Key: BHGCCJJOMNIVOA-UHFFFAOYSA-N
• Isomeric SMILES: C1=C(C2=C(N1)C(=C(C(=C2F)F)F)F)C=O

• Molecular Formula: C9H3F4NO
• Molecular Weight: 217.12

• XLogP3-AA: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 217.01507637 g/mol
• Monoisotopic Mass: 217.01507637 g/mol
• Topological Polar Surface Area: 32.9Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 265