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146293

Ethyl (4-fluorobenzoyl)acetate

Synonym(s):

(p-Fluorobenzoyl)acetic acid ethyl ester, Ethyl 3-(4-fluorophenyl)-3-oxopropionate, Ethyl 4-fluorobenzoylacetate, 4-Fluoro-β-oxobenzenepropanoic acid ethyl ester

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5 g

Available to ship TODAYfromMILWAUKEE

$318.00
$238.50

About This Item

Linear Formula:
FC6H4COCH2CO2C2H5
CAS Number:
Molecular Weight:
210.20
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:

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refractive index

n20/D 1.5040 (lit.)

Quality Segment

bp

117-120 °C (lit.)

density

1.174 g/mL at 25 °C (lit.)

functional group

ester, fluoro, ketone

SMILES string

CCOC(=O)CC(=O)c1ccc(F)cc1

InChI

1S/C11H11FO3/c1-2-15-11(14)7-10(13)8-3-5-9(12)6-4-8/h3-6H,2,7H2,1H3

InChI key

SJUXLKYJKQBZLM-UHFFFAOYSA-N

General description

Ethyl (4-fluorobenzoyl)acetate on condensation with benzofurazan oxide yields 2-(carboethoxy)-3-(4′-fluoro)phenylquinoxaline1,4-dioxide.

Application

Reactant used as a precursor in:
  • Condensation reactions with diamines via C-C bond cleavage for synthesis of benzimidazoles and perimidines for possible use as antimalarial treatments
  • Base-promoted domino Michael addition / cyclization / elimination reactions for synthesis of hydroxybenzophenones
  • Oxidative cross-coupling with indoles via dioxygen activation
  • Cyclization of keto esters for synthesis of pyrones
  • Lewis base catalyzed hydrosilylation for synthesis of α-acetoxy β-amino acid derivatives
  • Conia-ene reactions for synthesis of methylenecyclopentane derivatives

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This Item
119946559210133973
Quality Level

100

Quality Level

200

Quality Level

100

Quality Level

200

bp

117-120 °C (lit.)

bp

82 °C/20 mmHg (lit.)

bp

268-269 °C (lit.)

bp

159 °C (lit.)

refractive index

n20/D 1.5040 (lit.)

refractive index

n20/D 1.532 (lit.)

refractive index

n20/D 1.5500 (lit.)

refractive index

n20/D 1.451 (lit.)

density

1.174 g/mL at 25 °C (lit.)

density

1.342 g/mL at 25 °C (lit.)

density

1.218 g/mL at 25 °C (lit.)

density

1.506 g/mL at 25 °C (lit.)

functional group

ester, ketone, fluoro

functional group

acyl chloride, fluoro

functional group

chloro, ester, ketone

functional group

bromo, ester


Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves



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Related Content


Comparative Use of Solvent-free KF-Al2O3 and K2CO3 in Acetone in the Synthesis of Quinoxaline 1, 4-Dioxide Derivatives Designed as Antimalarial Drug Candidates.
Lima LM, et al.
Journal of Heterocyclic Chemistry, 42(7), 1381-1385 (2005)



Global Trade Item Number

SKUGTIN
146293-5G04061831818697
146293-1G04061825583006

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