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Sigma-Aldrich

Ethyl 4-fluorobenzoate

99%

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About This Item

Linear Formula:
FC6H4CO2C2H5
CAS Number:
451-46-7
Molecular Weight:
168.16
Beilstein/REAXYS Number:
1866794
EC Number:
207-194-8
MDL number:
MFCD00000351
UNSPSC Code:
12352100
PubChem Substance ID:
24846584
NACRES:
NA.22

assay

99%

refractive index

n20/D 1.486 (lit.)

bp

210 °C (lit.)

density

1.146 g/mL at 25 °C (lit.)

SMILES string

CCOC(=O)c1ccc(F)cc1

InChI

1S/C9H9FO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3

InChI key

UMPRJGKLMUDRHL-UHFFFAOYSA-N

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General description

Ethyl 4-fluorobenzoate is a clear colorless liquid. The purified [18F]fluoride is used for solution phase nucleophilic labeling of ethyl [18F]4-fluorobenzoate. Ethyl 4-fluorobenzoate causes N-arylation of 5-methoxyindole in presence of 18-crown-6 by using microwave-assisted technology.

Application

Ethyl 4-fluorobenzoate may be used in the synthesis of 4,4′-(1,4-piperazinediyl) bisbenzoic acid ethyl ester.

Storage Class

10 - Combustible liquids

wgk_germany

WGK 3

flash_point_f

177.8 °F - closed cup

flash_point_c

81 °C - closed cup

ppe

Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)

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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Investigation of the N-arylation of various substituted indoles using microwave-assisted technology.
Frayne GL and Green GM.
Tetrahedron Letters, 49(51), 7328-7329 (2008)
M Martínez-Bueno et al.
Plasmid, 28(1), 61-69 (1992-07-01)
Production of bacteriocin Bc-48 by Enterococcus faecalis S-48 is encoded by the conjugative plasmid pMB1, which is approximately 90 kb and also responds to sex pheromones of E. faecalis OG1X. Mutants harboring deleted forms of this plasmid (pMB1-del, 75 kb)
G K Mulholland
International journal of radiation applications and instrumentation. Part A, Applied radiation and isotopes, 42(11), 1003-1008 (1991-01-01)
No-carrier-added trimethylsilyl[18F]fluoride (TMS[18F]F) was rapidly liberated from a variety of dry supports containing unreactive [18F]fluoride by simply heating with neat bistrimethylsilylsulfate. The supports included calcium phosphate, anion exchange resins, alumina, borosilicate and porous carbon beads, to which [18F]fluoride was applied

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