4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid

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4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid Basic information
Product Name:4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid
Synonyms:4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid;3-Trifluoromethyl-4-AminoBenzoicAcid;4-Amino-5-trifluoromethylbenzoic Acid;4-AMino-α,α,α-trifluoro-M-toluic Acid;4-Amino-3-(trifluoromethyl)benzoic acid 98%;Benzoic acid, 4-amino-3-(trifluoromethyl)-
CAS:400-76-0
MF:C8H6F3NO2
MW:205.13
EINECS:630-042-0
Product Categories:Fluorine series;Amines;Aromatics;Miscellaneous Reagents;Benzoic acid
Mol File:400-76-0.mol
4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid Structure
4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid Chemical Properties
Melting point 204-206°C
Boiling point 319.1±42.0 °C(Predicted)
density 1.489
storage temp. Sealed in dry,Room Temperature
solubility DMSO, Methaniol
pka4.43±0.10(Predicted)
form Solid
color Off-White to Pale Yellow
Sensitive Air Sensitive
InChIInChI=1S/C8H6F3NO2/c9-8(10,11)5-3-4(7(13)14)1-2-6(5)12/h1-3H,12H2,(H,13,14)
InChIKeyNPPPORJZPNJXNQ-UHFFFAOYSA-N
SMILESC(O)(=O)C1=CC=C(N)C(C(F)(F)F)=C1
Safety Information
Hazard Codes Xi
HazardClass IRRITANT
HS Code 2922290090
MSDS Information
4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid Usage And Synthesis
Chemical PropertiesWhite Solid
Synthesis
4-NITRO-3-(TRIFLUOROMETHYL)BENZOIC ACID&

320-38-7

4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid

400-76-0

General procedure for the synthesis of 3-trifluoromethyl-4-aminobenzoic acid from 4-nitro-3-(trifluoromethyl)benzoic acid: 4-nitro-3-(trifluoromethyl)benzoic acid (1 g, 4.25 mmol) was dissolved in methanol at room temperature, 10% Pd/C catalyst was added, and the hydrogenation reaction was carried out overnight under hydrogen atmosphere (balloon pressure). Upon completion of the reaction, the catalyst was removed by filtration and the solvent was evaporated to give the colorless solid product 3-trifluoromethyl-4-aminobenzoic acid (870 mg, quantitative yield).

References[1] Patent: WO2010/132615, 2010, A1. Location in patent: Page/Page column 119
[2] Journal of the American Chemical Society, 1951, vol. 73, p. 5125
4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid Preparation Products And Raw materials
Raw materials4-Nitro-3-(trifluoromethyl)benzoic acid&-->Methanol-->Hydrogen
Preparation Products4-amino-3-chloro-5-trifluoromethyl-benzoic acid-->4-Iodo-3-(trifluoromethyl)benzoic acid
Tag:4-Amino-3-(Trifluoromethyl)Benzoic Acid 3-Trifluoromethyl-4-Aminobenzoic Acid(400-76-0) Related Product Information
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