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136476

Sigma-Aldrich

2-(4-Fluorobenzoyl)benzoic acid

97%

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Linear Formula:
FC6H4COC6H4CO2H
CAS Number:
Molecular Weight:
244.22
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

form

solid

mp

138-140 °C (lit.)

SMILES string

OC(=O)c1ccccc1C(=O)c2ccc(F)cc2

InChI

1S/C14H9FO3/c15-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)14(17)18/h1-8H,(H,17,18)

InChI key

FJAZVXUPZQSZKI-UHFFFAOYSA-N

General description

2-(4-Fluorobenzoyl)benzoic acid on nitration with fuming HNO3 yields 2-(4-fluoro-3-nitrobenzoyl)benzoic acid.

Application

2-(4-Fluorobenzoyl)benzoic acid was used to prepare starting material for the synthesis of 9-fluoro-7H-benz(de)anthracene-7-one. It was used as starting reagent for the synthesis of Heparan sulfate glycosaminoglycans (HSGAG)-mimetic compounds.

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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Keisuke Ishida et al.
Chemistry & biology, 11(3), 367-377 (2004-05-05)
Heparan sulfate glycosaminoglycans (HSGAGs) are involved in tumor cell growth, adhesion, invasion, and migration, due to their interactions with various proteins. In this study, novel HSGAG-mimetic compounds (KI compounds) were designed and synthesized. As a result of cell-based assays, KI-105
Active sites in dibenzopyrenes: Synthesis and studies of 3-fluoro-and 2, 10-difluorobenzo (RST) pentaphene.
Boger E, et al.
Journal of Fluorine Chemistry, 8(6), 513-525 (1976)

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