4-Fluoroindole

• Catalog: OFC387439
• CAS: 387-43-9
• Category: Fluorinated Indoles
• Synonyms: 4-Fluoro-1H-indole
• Purity: >98.0%(GC)
• MDL Number: MFCD00055992

• IUPAC Name: 4-fluoro-1H-indole
• InChI: InChI=1S/C8H6FN/c9-7-2-1-3-8-6(7)4-5-10-8/h1-5,10H
• InChI Key: ZWKIJOPJWWZLDI-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC2=C(C=CN2)C(=C1)F
• EC Number: 625-248-2

• Molecular Formula: C8H6FN
• Molecular Weight: 135.14
• Melting Point: 33 °C
• Boiling Point: 90 °C (0.4 mmHg)
• Appearance: White or colorless to brown powder to lump to clear liquid
• Solubility: Soluble in methanol
• Storage: Store under inert gas
• Stability: Light sensitive, air sensitive

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 135.048427358 g/mol
• Monoisotopic Mass: 135.048427358 g/mol
• Topological Polar Surface Area: 15.8Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 126

• HS Number: 2933.99.8290