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[3,5-Bis(trifluoromethyl)phenyl]acetic acid(CAS: 85068-33-3)

[3,5-Bis(trifluoromethyl)phenyl]acetic acid
CAS Number

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Basic Information

Molecular Formula
C10H6F6O2
Molecular Weight
272.14 g/mol

Physical Properties

Melting Point
125.0 to 129.0 deg-C
Density
1.4478 (estimate)
Flash Point
91.5℃

Chemical Identifiers

SMILES
OC(=O)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F
InChIKey
PAWSKKHEEYTXSA-UHFFFAOYSA-N

Database References

MDL Number
MFCD00009908
Beilstein Registry Number
6813447

FAQ

[3,5-Bis(trifluoromethyl)phenyl]acetic acid (CAS: 85068-33-3) is a highly reactive compound with a crystalline form. It has a molecular weight of approximately 354.15 g/mol. The compound is slightly soluble in water but soluble in organic solvents like ethanol and acetone. It exhibits strong acidity and can undergo various reactions such as esterification and nucleophilic substitution.
[3,5-Bis(trifluoromethyl)phenyl]acetic acid (CAS: 85068-33-3) can be synthesized by the acetylation of 3,5-bis(trifluoromethyl)phenol using acetic anhydride in the presence of a catalyst like pyridine. The reaction is typically carried out under mild conditions to achieve high yield and selectivity. This compound is also synthesized by the oxidation of 3,5-bis(trifluoromethyl)toluene with sodium hypochlorite.
[3,5-Bis(trifluoromethyl)phenyl]acetic acid (CAS: 85068-33-3) is used in the pharmaceutical industry for the synthesis of certain drugs, in the polymer industry for enhancing properties of polymers, and in the electronics industry for the production of sensors and semiconductors. It is also utilized in the preparation of various organic compounds for research and development.
When handling [3,5-Bis(trifluoromethyl)phenyl]acetic acid (CAS: 85068-33-3), it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood due to its volatility and reactivity. Spills should be handled carefully using appropriate spill kits, and the material safety data sheet (MSDS) should be consulted for detailed safety information.

Safety Notice

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