5-Fluoro-2-methyl-1H-indole-3-carbaldehyde

• Catalog: OFC815586686
• CAS: 815586-68-6
• Category: Fluorinated Indoles
• Synonyms: 5-FLUORO-3-FORMYL-2-METHYL-INDOLE
• Purity: 98%
• MDL Number: MFCD07643210

• IUPAC Name: 5-fluoro-2-methyl-1H-indole-3-carbaldehyde
• InChI: InChI=1S/C10H8FNO/c1-6-9(5-13)8-4-7(11)2-3-10(8)12-6/h2-5,12H,1H3
• InChI Key: FISQQNGEDJOACY-UHFFFAOYSA-N
• Isomeric SMILES: CC1=C(C2=C(N1)C=CC(=C2)F)C=O

• Molecular Formula: C10H8FNO
• Molecular Weight: 177.18
• Storage: Inert atmosphere, 2-8 °C

• XLogP3-AA: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 177.058992041 g/mol
• Monoisotopic Mass: 177.058992041 g/mol
• Topological Polar Surface Area: 32.9Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 209