CAS 122030-03-9

1-Chloro-2,4,5-trifluoro-3-(trifluoromethyl)benzene

Description:

1-Chloro-2,4,5-trifluoro-3-(trifluoromethyl)benzene, with the CAS number 122030-03-9, is a halogenated aromatic compound characterized by the presence of both chlorine and multiple fluorine substituents on a benzene ring. This compound features a chloro group at the first position and trifluoromethyl groups at the third and fourth positions, along with a trifluoro group at the second position. The presence of these electronegative halogens significantly influences its chemical properties, including increased stability and lipophilicity. It is typically a colorless to pale yellow liquid or solid, depending on the temperature, and exhibits low volatility. The compound is of interest in various applications, including as an intermediate in the synthesis of agrochemicals and pharmaceuticals. Its unique electronic properties may also make it suitable for use in materials science and as a solvent in specific chemical reactions. However, due to the presence of halogens, it may pose environmental and health risks, necessitating careful handling and disposal.

Formula: C₇HClF₆

InChI: InChI=1S/C7HClF6/c8-2-1-3(9)6(11)4(5(2)10)7(12,13)14/h1H

InChI key: InChIKey=GXUFAKYHNRIOOV-UHFFFAOYSA-N

SMILES: C(F)(F)(F)C1=C(F)C(Cl)=CC(F)=C1F

Synonyms:

• Benzene, 1-chloro-2,4,5-trifluoro-3-(trifluoromethyl)-
• 1-Chloro-2,4,5-trifluoro-3-(trifluoromethyl)benzene