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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>7</sub>H<sub>7</sub>F<sub>2</sub>I

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Extracted from

Scheme 1

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₇H₇F₂I
Molecular Weight	256.03 g/mol
Exact Mass	255.9561 Da
InChI	InChI=1S/C7H7F2I/c1-6-2-4-7(5-3-6)10(8)9/h2-5H,1H3
InChIKey	ROJCSEAEQFJFGO-UHFFFAOYSA-N
SMILES	CC1=CC=C(C=C1)I(F)F
Number of Atoms	17
Number of H-Bond Acceptors	0
Number of H-Bond Donors	0
Atoms in the Largest π-System	6
XLogP	3.3

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