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455326

Sigma-Aldrich

3-Fluoro-5-(trifluoromethyl)benzoic acid

98%

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About This Item

Linear Formula:
FC6H3(CF3)CO2H
CAS Number:
Molecular Weight:
208.11
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

98%

mp

104-108 °C (lit.)

SMILES string

OC(=O)c1cc(F)cc(c1)C(F)(F)F

InChI

1S/C8H4F4O2/c9-6-2-4(7(13)14)1-5(3-6)8(10,11)12/h1-3H,(H,13,14)

InChI key

NSGKIIGVPBTOBF-UHFFFAOYSA-N

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves


Certificates of Analysis (COA)

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Marco Schaudt et al.
Bioorganic & medicinal chemistry letters, 20(3), 1225-1228 (2009-12-18)
The synthesis and SAR of two series of bradykinin B(1) receptor antagonists is described. The benzamide moiety proved to be a suitable replacement for the aryl ester functionality of biaryl based antagonists. In addition, it was found that semicarbazides can

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