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559245

Sigma-Aldrich

Ethyl (3-trifluoromethylbenzoyl)acetate

97%

Synonym(s):

3-(3-Trifluoromethylphenyl)-3-oxo-propionic acid ethyl ester, Ethyl 2-(3-trifluoromethylbenzoyl)acetate, Ethyl 3-(3-trifluoromethylphenyl)-3-oxopropanoate

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About This Item

Linear Formula:
CF3C6H4COCH2CO2C2H5
CAS Number:
Molecular Weight:
260.21
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

form

liquid

refractive index

n20/D 1.4850 (lit.)

bp

250-251 °C (lit.)

density

1.267 g/mL at 25 °C (lit.)

SMILES string

CCOC(=O)CC(=O)c1cccc(c1)C(F)(F)F

InChI

1S/C12H11F3O3/c1-2-18-11(17)7-10(16)8-4-3-5-9(6-8)12(13,14)15/h3-6H,2,7H2,1H3

InChI key

YCHPVUWFIZXXPI-UHFFFAOYSA-N

Application

Reactant for:
  • Preparation of pyrido[1,2-a]benzimidazoles as cytotoxic and antiplasmodial agent
  • Preparation of diaryl-substituted pyrazoles as potent CCR2 receptor antagonists
  • Acid-catalyzed addition/annulation reactions
  • Cyclocondensation with diaminophenylpyrazole

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

JAN Code

559245-1G:
559245-5G:
559245-BULK:
559245-VAR:


Certificates of Analysis (COA)

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