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Key Documents

431141

Sigma-Aldrich

2-Amino-3-(trifluoromethyl)benzoic acid

98% dry basis

Synonym(s):

3-(Trifluoromethyl)anthranilic acid

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About This Item

Linear Formula:
CF3C6H3-2-(NH2)CO2H
CAS Number:
Molecular Weight:
205.13
Beilstein/REAXYS Number:
2844022
MDL number:
UNSPSC Code:
12352200
PubChem Substance ID:
NACRES:
NA.22

assay

98% dry basis

form

solid

reaction suitability

reaction type: solution phase peptide synthesis

impurities

≤4.0% Water (Karl Fischer)

mp

157-160 °C (lit.)

application(s)

peptide synthesis

SMILES string

Nc1c(cccc1C(F)(F)F)C(O)=O

InChI

1S/C8H6F3NO2/c9-8(10,11)5-3-1-2-4(6(5)12)7(13)14/h1-3H,12H2,(H,13,14)

InChI key

UNLVJVQEDSDPIN-UHFFFAOYSA-N

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Application

A useful intermediate for the syntheses of antimicrobial benzoisothiazolones and dithiobis(benzamides).

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

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


Certificates of Analysis (COA)

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European Journal of Medicinal Chemistry, 29, 743-743 (1994)

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