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Bromopentafluorobenzene

Chemical compound From Wikipedia, the free encyclopedia

Bromopentafluorobenzene is an organofluorine compound with the formula C6F5Br. It is a colorless liquid that is used to prepare pentafluophenyl compounds. These syntheses typically proceed via the intermediacy of C6F5Li or the Grignard reagent.[1] Illustrative is preparation of tris(pentafluorophenyl)borane:[2]

3 C6F5MgBr + BCl3 → (C6F5)3B + 3 MgBrCl
Quick facts Names, Identifiers ...
Bromopentafluorobenzene
Names
Preferred IUPAC name
Bromopenta(fluoro)benzene
Other names
Bromoperfluorobenzene
Identifiers
3D model (JSmol)
ChEMBL
ChemSpider
ECHA InfoCard 100.005.863 Edit this at Wikidata
EC Number
  • 206-449-0
UNII
  • InChI=1S/C6BrF5/c7-1-2(8)4(10)6(12)5(11)3(1)9
    Key: XEKTVXADUPBFOA-UHFFFAOYSA-N
  • C1(=C(C(=C(C(=C1F)F)Br)F)F)F
Properties
C6BrF5
Molar mass 246.962 g·mol−1
Appearance colorless liquid
Density 1.9503 g/cm3
Melting point −31 °C (−24 °F; 242 K)
Boiling point 137 °C (279 °F; 410 K)
low
Hazards
GHS labelling:
GHS07: Exclamation mark
Warning
H315, H319, H335
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
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Other derivatives include LiB(C6F5)4,[3] [CuC6F5]4,[1] and Ni(C6F5)2(dioxane)2.[4]

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