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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>5</sub>BrMg

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Extracted from

Scheme 6

Chemical Information

Calculated using the Chemistry Development Kit 2.12

Property Name	Property Value
Molecular Formula	C₆H₅BrMg
Molecular Weight	181.31 g/mol
Exact Mass	179.9425 Da
InChI	InChI=1S/C6H5.BrH.Mg/c1-2-4-6-5-3-1;;/h1-5H;1H;/q;;+1/p-1
InChIKey	ANRQGKOBLBYXFM-UHFFFAOYSA-M
SMILES	C1=CC=C(C=C1)[Mg]Br
Number of Atoms	13
Number of H-Bond Acceptors	0
Number of H-Bond Donors	0
Atoms in the Largest π-System	6
XLogP	1.8

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