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1,4-DIIODOTETRAFLUOROBENZENE is a white powder chemical compound known for its unique properties, particularly its ability to form trimeric complexes as new, halogen-bonded mesogens with two molecules of alkoxystilbazole. It has been studied for its electron density and its role in the formation of halogen-bonded complexes, making it a promising candidate for various applications in different industries.

392-57-4

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392-57-4 Usage

Uses

Used in Phosphorescent Cocrystal Preparation:
1,4-DIIODOTETRAFLUOROBENZENE is used as a halogen bonding donor for the preparation of phosphorescent cocrystals with polycyclic aromatic hydrocarbons. Its unique halogen bonding properties enable the formation of these cocrystals, which have potential applications in various fields, such as optoelectronics and materials science.
Used in Halogen-Bonded Mesogens:
1,4-DIIODOTETRAFLUOROBENZENE is used as a key component in the formation of halogen-bonded mesogens. It forms trimeric complexes with two molecules of alkoxystilbazole, creating new mesogenic materials with potential applications in the development of advanced materials for various industries, including electronics and pharmaceuticals.
Used in Electron Density Studies:
1,4-DIIODOTETRAFLUOROBENZENE is used in the study of electron density, particularly in the context of halogen-bonded complexes. The electron density study of the halogen-bonded complex of 4,4′-dipyridyl-N,N′-dioxide with 1,4-diiodotetrafluorobenzene at 90K has been reported, contributing to the understanding of the underlying chemistry and potential applications of these complexes.
Used in Chemical Research and Development:
1,4-DIIODOTETRAFLUOROBENZENE is used as a research compound in the development of new materials and chemical processes. Its unique properties and reactivity make it a valuable tool for scientists and researchers working in various fields, such as materials science, pharmaceuticals, and electronics.

Check Digit Verification of cas no

The CAS Registry Mumber 392-57-4 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 3,9 and 2 respectively; the second part has 2 digits, 5 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 392-57:
(5*3)+(4*9)+(3*2)+(2*5)+(1*7)=74
74 % 10 = 4
So 392-57-4 is a valid CAS Registry Number.
InChI:InChI=1/C6F4I2/c7-1-2(8)6(12)4(10)3(9)5(1)11

392-57-4SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,4-DIIODOTETRAFLUOROBENZENE

1.2 Other means of identification

Product number -
Other names 1,2,4,5-Tetrafluoro-3,6-diiodobenzene

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:392-57-4 SDS

392-57-4Relevant academic research and scientific papers

Supramolecular sandwiches: Halogen-bonded coformers direct [2+2] photoreactivity in two-component cocrystals

MacGillivray, Leonard R.,Quentin, Jay,Swenson, Dale C.

, (2020)

The halogen-bond (X-bond) donors 1,3- and 1,4-diiodotetrafluorobenzene (1,3-di-I-tFb and 1,4-di-I-tFb, respectively) form cocrystals with trans-1,2-bis(2-pyridyl)ethylene (2,2′-bpe) assembled by N···I X-bonds. In each cocrystal, 2(1,3-di-I-tFb)·2(2,2′-bpe

Utilising Sodium-Mediated Ferration for Regioselective Functionalisation of Fluoroarenes via C?H and C?F Bond Activations

Maddock, Lewis C. H.,Nixon, Tracy,Kennedy, Alan R.,Probert, Michael R.,Clegg, William,Hevia, Eva

supporting information, p. 187 - 191 (2017/12/07)

Pairing iron bis(amide) Fe(HMDS)2 with Na(HMDS) to form new sodium ferrate base [(dioxane)0.5?NaFe(HMDS)3] (1) enables regioselective mono and di-ferration (via direct Fe?H exchange) of a wide range of fluoroaromatic substrates under mild reaction conditions. Trapping of several ferrated intermediates has provided key insight into how synchronised Na/Fe cooperation operates in these transformations. Furthermore, using excess 1 at 80 °C switches on a remarkable cascade process inducing the collective twofold C?H/threefold C?F bond activations, where each C?H bond is transformed to a C?Fe bond whereas each C?F bond is transformed into a C?N bond.

A simple base-mediated halogenation of acidic sp2 C-H bonds under noncryogenic conditions

Do, Hien-Quang,Daugulis, Olafs

supporting information; experimental part, p. 421 - 423 (2009/07/04)

(Chemical Equation Presented) A new method has been developed for in situ halogenation of acidic sp2 carbon-hydrogen bonds in heterocycles and electron-deficient arenes. Either selective monohalogenation or one-step exhaustive polyhalogenation is possible for substrates possessing several C-H bonds that are flanked by electron-withdrawing groups. For the most acidic arenes, such as pentafluorobenzene, K3PO4 base can be employed instead of BuLi for metalation/halogenation sequences.

Halogenation reactions

-

, (2008/06/13)

A method of halogenating an aromatic compound which comprises the steps of reacting an halogenating agent with the aromatic compound in the presence of fluorine and an acid, wherein the halogenating agent is at least one of an iodinating agent, a brominating agent and an chlorinating agent.

Elemental fluorine. Part 4. Use of elemental fluorine for the halogenation of aromatics

Chambers, Richard D.,Skinner, Christopher J.,Atherton, Malcolm J.,Moilliet, John S.

, p. 1659 - 1664 (2007/10/03)

New methodolgy for direct iodination of benzenoid compounds has been developed; the aromatic substrate is simply mixed with iodine and sulfuric acid, suspended in an inert medium, such as 1,1,2-trichlorotrifluoroethane (CF2ClCFCl2) or perfluorocarbon, and elemental fluorine is passed through the system at room temperature. High conversions to iodoaromatic products occur, even with some deactivated systems, e.g. nitrobenzene. A very powerful brominating system is produced using the analagous methodology.

C-I STRETCHING VIBRATIONS IN IODOBENZENES

Fugaeva, O.M.,Korobeinicheva, I.K.,Bardin, V.V.

, p. 2309 - 2311 (2007/10/02)

Comparison of the calculated and experimental IR and Raman spectra of a series of iodobenzenes showed that the C-I stretching vibrations for these compounds correspond to a very highly polarized Raman band 150 - 270 cm-1 (ρ = 0.1).The position of this band depends on the mass of the para substituent and relative position of the fluorine and iodine atoms in the molecule.The UV absorption spectral data indicate an interaction of the iodine atom and para substituents through the ?-system.Opposite substituent effects on the change in intensity of the B-band in the UV spectra of iodobenzenes and tetrafluoroiodobenzenes were noted.

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