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263419 Sigma-Aldrich

3,5-Bis(trifluoromethyl)phenylacetic acid

98%

  • CAS Number 85068-33-3

  • Linear Formula (CF3)2C6H3CH2CO2H

  • Molecular Weight 272.14

  •  Beilstein/REAXYS Number 6813447

  •  EC Number 285-295-6

  •  MDL number MFCD00009908

  •  PubChem Substance ID 24855970

  •  NACRES NA.22

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Properties

Related Categories Building Blocks, C10, Carbonyl Compounds, Carboxylic Acids, Chemical Synthesis,
Quality Level   100
assay   98%
mp   121-123 °C (lit.)
solubility   methanol: soluble 25 mg/mL, clear, colorless
SMILES string   OC(=O)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F
InChI   1S/C10H6F6O2/c11-9(12,13)6-1-5(3-8(17)18)2-7(4-6)10(14,15)16/h1-2,4H,3H2,(H,17,18)
InChI key   PAWSKKHEEYTXSA-UHFFFAOYSA-N

Description

Application

3,5-Bis(trifluoromethyl)phenylacetic acid has been used:
• as building block to synthesize the pentaamine and bis-heterocyclic libraries
• in determination of ionic perfluorinated substances and telomers in leachates from landfills and sediment samples

Packaging

5 g in glass bottle

Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Precautionary statements 
Target organs 
Respiratory system
Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
Not applicable
Flash Point(C) 
Not applicable
Protocols & Articles
Peer-Reviewed Papers
15

References

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