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Oxidative fluorination with Selectfluor: A convenient procedure for preparing hypervalent iodine(V) fluorides

Samuel M. G. Dearman, Xiang Li, Yang Li, Kuldip Singh and Alison M. Stuart

Beilstein J. Org. Chem. 2024, 20, 1785–1793. https://doi.org/10.3762/bjoc.20.157

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Chemical structure C<sub>6</sub>H<sub>4</sub>FI

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Extracted from

Scheme 2

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₆H₄FI
Molecular Weight	222.00 g/mol
Exact Mass	221.9342 Da
InChI	InChI=1S/C6H4FI/c7-5-1-3-6(8)4-2-5/h1-4H
InChIKey	KGNQDBQYEBMPFZ-UHFFFAOYSA-N
SMILES	C1=C(C=CC(=C1)I)F
Number of Atoms	12
Number of H-Bond Acceptors	0
Number of H-Bond Donors	0
Atoms in the Largest π-System	6
XLogP	2.0

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