Trifluoromethylbenzene: A Versatile Fluorinated Compound

Trifluoromethylbenzene, also known as alpha,alpha,alpha-Trifluorotoluene, is a highly versatile and pure chemical compound that finds its applications in a wide range of scientific and industrial domains. With its unique combination of a benzene ring and a trifluoromethyl group, this Fluorinated Compound offers a distinct set of properties that make it a valuable asset for researchers, chemists, and innovators.

Boasting a CAS number of 98-08-8 and a molecular formula of C7H5F3, this clear liquid compound has a molecular weight of 146.11 g/mol. Its IUPAC name, trifluoromethylbenzene, provides a clear indication of its chemical structure, which is further characterized by the InChI code InChI=1S/C7H5F3/c8-7(9,10)6-4-2-1-3-5-6 and the SMILES notation FC(F)(F)c1ccccc1. These identifiers ensure precise and unambiguous communication among the scientific community.

Key Applications

Pharmaceutical Research

Trifluoromethylbenzene is a valuable building block in the synthesis of pharmaceutical compounds. Its unique chemical properties and reactivity allow researchers to incorporate the trifluoromethyl moiety into drug candidates, potentially enhancing their pharmacological profiles and therapeutic efficacy. This compound's versatility enables the development of innovative treatments targeting a wide range of health conditions.

Agrochemical Development

In the field of agrochemicals, trifluoromethylbenzene contributes to the creation of advanced crop protection agents. The trifluoromethyl group, when strategically incorporated into pesticide structures, can lead to increased potency, selectivity, and environmental compatibility. This, in turn, helps to safeguard crops, improve yields, and minimize the impact on the surrounding ecosystem.

Chemical Synthesis

As a versatile fluorinated compound, trifluoromethylbenzene finds widespread use in organic synthesis and the development of novel materials. Its distinct chemical properties, such as thermal stability and reactivity, make it a valuable reagent and intermediate in the creation of a wide range of compounds with tailored characteristics. Researchers in various fields, from materials science to organic chemistry, leverage the unique attributes of trifluoromethylbenzene to push the boundaries of scientific discovery.

Product Specifications

• Appearance: Clear Liquid
• Density: 1.2 g/cm³ at 20 °C
• Boiling Point: 102 °C (216 °F)
• Melting Point: -29 °C (-20 °F)
• Molecular Weight: 146.11 g/mol
• HS Code: 29039980
• InChI Key: InChIKey=GETTZEONDQJALK-UHFFFAOYSA-N

Handling and Storage

Trifluoromethylbenzene is classified as a flammable liquid and vapor (H225) and is toxic to aquatic life with long-lasting effects (H411). Appropriate safety precautions must be taken when handling this compound, including the use of personal protective equipment (PPE) and working in a well-ventilated area. The compound should be stored in a cool, dry environment, away from sources of ignition and heat, to maintain its stability and purity over the long term.

Further Resources

For more detailed information on the applications, technical specifications, and safety guidelines for trifluoromethyl