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| IUPAC Name: | 5-fluoro-1H-indole |
| Description: | 5-Fluoroindole (CAS# 399-52-0) is a reactant used in various syntheses. It was used in the synthesis of Spirotetrahydro β-Carbolines (Spiroindolones), which is a new class of potent and orally efficacious compounds for the treatment of malaria. 5-Fluoroindole was also a reactant in direct indole and pyrrole couplings to carbonyl compound in total synthesis of Acremoauxin A and Oxazinin 3. |
| Molecular Weight: | 135.14 |
| Molecular Formula: | C8H6FN |
| Canonical SMILES: | C1=CC2=C(C=CN2)C=C1F |
| InChI: | InChI=1S/C8H6FN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H |
| InChI Key: | ODFFPRGJZRXNHZ-UHFFFAOYSA-N |
| Boiling Point: | 258 °C at 760 mmHg |
| Melting Point: | 44-48 °C |
| Purity: | 95 % |
| Density: | 1.273 g/cm3 |
| Appearance: | Off-white crystalline powder |
| Storage: | 2-8 °C |
| MDL: | MFCD00005671 |
| LogP: | 2.30700 |
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