5-Fluoro-6-methoxy-1H-indole

• Catalog: OFC1211595720
• CAS: 1211595-72-0
• Category: Fluorinated Indoles
• Purity: 98%
• MDL Number: MFCD11109586

• IUPAC Name: 5-fluoro-6-methoxy-1H-indole
• InChI: InChI=1S/C9H8FNO/c1-12-9-5-8-6(2-3-11-8)4-7(9)10/h2-5,11H,1H3
• InChI Key: NXXKLZQLVSSDKK-UHFFFAOYSA-N
• Isomeric SMILES: COC1=C(C=C2C=CNC2=C1)F

• Molecular Formula: C9H8FNO
• Molecular Weight: 165.16
• Storage: Sealed in dry, room temperature

• XLogP3-AA: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 165.058992041 g/mol
• Monoisotopic Mass: 165.058992041 g/mol
• Topological Polar Surface Area: 25Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 165