Methyl 5-fluoro-1H-indole-2-carboxylate

• Catalog: OFC167631847
• CAS: 167631-84-7
• Category: Fluorinated Indoles
• Synonyms: 1H-Indole-2-carboxylic acid, 5-fluoro-, methyl ester
• Purity: >95%
• MDL Number: MFCD04972072

• IUPAC Name: methyl 5-fluoro-1H-indole-2-carboxylate
• InChI: InChI=1S/C10H8FNO2/c1-14-10(13)9-5-6-4-7(11)2-3-8(6)12-9/h2-5,12H,1H3
• InChI Key: QUZGGDBUGGJROM-UHFFFAOYSA-N
• Isomeric SMILES: COC(=O)C1=CC2=C(N1)C=CC(=C2)F

• Molecular Formula: C10H8FNO2
• Molecular Weight: 193.17

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 193.05390666 g/mol
• Monoisotopic Mass: 193.05390666 g/mol
• Topological Polar Surface Area: 42.1Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 234