41860-63-3

Basic information

• Product Name: 2,4,6-TRIFLUOROIODOBENZENE
• Synonyms: 1,2,4-trifluoro-5-iodobenzene;1,3,5-Trifluoro-2-iodobenzene
• CAS NO: 41860-63-3
• Molecular Formula: C₆H₂F₃I
• Molecular Weight: 257.98
• Product Categories: Miscellaneous
• Mol File: 41860-63-3.mol

Chemical Properties

• Melting Point: 28-29℃
• Boiling Point: 171℃
• Flash Point: 63℃
• Appearance: /
• Density: 2.078
• Vapor Pressure: 1.26mmHg at 25°C
• Refractive Index: 1.543
• Storage Temp.: 2-8°C(protect from light)
• CAS DataBase Reference: 2,4,6-TRIFLUOROIODOBENZENE(CAS DataBase Reference)
• NIST Chemistry Reference: 2,4,6-TRIFLUOROIODOBENZENE(41860-63-3)
• EPA Substance Registry System: 2,4,6-TRIFLUOROIODOBENZENE(41860-63-3)

Safety Data

• Hazardous Substances Data: 41860-63-3(Hazardous Substances Data)

Usage

Uses

Used in Organic Synthesis:
2,4,6-Trifluoroiodobenzene is utilized as a key building block in organic synthesis for the creation of a wide range of chemical compounds. Its unique structure allows for various chemical reactions, making it a valuable component in the synthesis process.
Used in Agrochemical Production:
In the agrochemical industry, 2,4,6-Trifluoroiodobenzene is employed as an important intermediate. It plays a crucial role in the production of various agrochemicals, contributing to the development of effective and efficient products for agricultural applications.
Used in Pharmaceutical Manufacturing:
2,4,6-Trifluoroiodobenzene is used as a vital intermediate in the pharmaceutical industry. It aids in the synthesis of a variety of pharmaceuticals, including those with potential therapeutic benefits.
Used in Material Science for Electronic and Optical Applications:
Owing to its distinctive properties, 2,4,6-Trifluoroiodobenzene is applied in the development of new materials for electronic and optical applications. Its unique characteristics make it suitable for creating advanced materials with specific functionalities required in these high-tech fields.
Used in Medicinal Chemistry:
In the realm of medicinal chemistry, 2,4,6-Trifluoroiodobenzene serves as a starting material for the synthesis of biologically active compounds. Its potential in this area highlights its importance in the discovery and development of new drugs and therapeutic agents.

InChI:InChI=1/C6H2F3I/c7-3-1-5(9)6(10)2-4(3)8/h1-2H

Upstream product

• 372-38-3 1,3,5-trifluorobenzene 

Downstream Products

• 84322-55-4 1,3,5-trifluoro-2,4-diiodobenzene 

Relevant articles and documents

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

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.

TRICYCLIC COMPOUNDS AS mPGES-1 INHIBITORS

The present invention relates to tricyclic compounds of formula (I) or pharmaceutically acceptable salt thereof as mPGES-1 inhibitors. These compounds are inhibitors of the microsomal prostaglandin E synthase-1 (mPGES-1) enzyme and are therefore useful in the treatment of pain and/or inflammation from a variety of diseases or conditions, such as asthama, osteoarthritis, rheumatoid arthritis, acute or chronic pain and neurodegenerative diseases. (I)

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

(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.

In situ generation and trapping of aryllithium and arylpotassium species by halogen, sulfur, and carbon electrophiles

(Chemical Equation Presented) A general method has been developed for in situ trapping of arylmetal intermediates by halogen, sulfur, ketone, and aldehyde electrophiles affording the functionalization of the most acidic position in arene. Pentafluorobenzene, benzothiazole, and benzoxazole can be functionalized by using K3PO4 base. For less acidic arenes, tBuOLi base is required. Arenes with DMSO pKa values of 35 or less are reactive. 2009 American Chemical Society.

Method for producing tetrakis ( fluoroaryl) borate-magnesium compound

Fluoroaryl magnesium halide is reacted with a boron compound so that a molar ratio of the fluoroaryl magnesium halide to the boron compound is not less than 3.0 and not more than 3.7, so as to produce a tetrakis (fluoroaryl) borate·magnesium compound. With this method, there occurs no hydrogen fluoride which corrodes a producing apparatus and requires troublesome waste water treatment.

Extensive halogen scrambling and buttressing effects encountered upon treatment of oligobromoarenes with bases

As a rule, tri-, tetra- and pentahaloarenes readily undergo ortho-lithiation when treated with amide-type bases. However, halogen migration occurs whenever the substrate contains three or more contiguous halogen atoms, provided that at least one of them is bromine or iodine. Dismutation and reduction processes often take place concomitantly. In this manner, a variety of organometallic intermediates may be formed, the driving force always being a decrease in basicity. When no such energy gain can be achieved, a sterically crowded substrate may just turn out to be inert; this was found to be the case with 1,5-dibromo-3-fluoro-2-(trimethylsilyl)benzene, 1,5-dibromo-3-fluoro-2,4-bis(trimethylsilyl)benzene, and 1,5-dibromo-3-fluoro-2,4-diiodobenzene. Buttressing effects are apparently strong enough to prevent expedient deprotonation of those substrates.