CAS 201789-28-8

[2,4-bis(trifluoromethyl)phenyl]acetonitrile

Description:

[2,4-bis(trifluoromethyl)phenyl]acetonitrile is an organic compound characterized by its distinctive structure, which includes a phenyl ring substituted at the 2 and 4 positions with trifluoromethyl groups, along with an acetonitrile functional group. This compound is notable for its high electronegativity due to the presence of multiple trifluoromethyl groups, which can significantly influence its chemical reactivity and physical properties. It typically appears as a colorless to pale yellow liquid or solid, depending on the temperature and purity. The presence of the acetonitrile group contributes to its polarity, making it soluble in polar organic solvents. This compound is of interest in various fields, including pharmaceuticals and agrochemicals, due to its potential applications in synthesis and as an intermediate in chemical reactions. Additionally, its trifluoromethyl groups can enhance biological activity and lipophilicity, making it a valuable target for research and development in medicinal chemistry. Safety precautions should be observed when handling this compound, as it may pose health risks.

Formula: C₁₀H₅F₆N

InChI: InChI=1/C10H5F6N/c11-9(12,13)7-2-1-6(3-4-17)8(5-7)10(14,15)16/h1-2,5H,3H2

SMILES: c1cc(cc(c1CC#N)C(F)(F)F)C(F)(F)F

Synonyms:

• 2,4-Bis(trifluoromethyl)benzeneacetonitrile
• 2,4-Bis(trifluoromethyl)phenylacetonitrile
• Fxffr B1Cn Exfff
• [2,4-Bis(trifluoromethyl)phenyl]acetonitrile

2,4-Bis(trifluoromethyl)phenylacetonitrile

CAS: 201789-28-8

2,4-Bis(trifluoromethyl)phenylacetonitrile

Formula: C₁₀H₅F₆N

Purity: 98%

Color and Shape: Liquid

Molecular weight: 253.14g/mol

Ref: 54-PC9045