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263419

Sigma-Aldrich

3,5-Bis(trifluoromethyl)phenylacetic acid

98%

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About This Item

Linear Formula:
(CF3)2C6H3CH2CO2H
CAS Number:
85068-33-3
Molecular Weight:
272.14
Beilstein:
6813447
EC Number:
285-295-6
MDL number:
MFCD00009908
UNSPSC Code:
12352100
PubChem Substance ID:
24855970
NACRES:
NA.22

Assay

98%

form

solid

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

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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

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Trine Eggen et al.
The Science of the total environment, 408(21), 5147-5157 (2010-08-11)
Landfills have historically remained the most common methods of organized waste disposal and still remain so in many regions of the world. Thus, they may contain wastes resulting from several decades of disposal and decomposition with subsequent release of organic

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