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264482

Sigma-Aldrich

2,6-Difluorophenylacetic acid

97%

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About This Item

Linear Formula:
F2C6H3CH2CO2H
CAS Number:
Molecular Weight:
172.13
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:

assay

97%

mp

100-102 °C (lit.)

functional group

carboxylic acid
fluoro

SMILES string

OC(=O)Cc1c(F)cccc1F

InChI

1S/C8H6F2O2/c9-6-2-1-3-7(10)5(6)4-8(11)12/h1-3H,4H2,(H,11,12)

InChI key

FUGDCKXBUZFEON-UHFFFAOYSA-N

Application

2,6-Difluorophenylacetic acid has been used in the synthesis of:
  • α-azidoacetophenones
  • N-(2,6-difluorobenzyl)-N′-(1H-5-indazolyl)urea

pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves


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Bioorganic & medicinal chemistry, 15(1), 350-364 (2006-10-19)
In a previous study, we identified several structurally unrelated scaffolds of the Rho kinase inhibitor using pharmacophore information obtained from the results of a high-throughput screening and structural information from a homology model of Rho kinase. 1H-Indazole is one of

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