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4-Amino-3-methylbenzoic acid

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CAS:2486-70-6
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CAS:2486-70-6
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4-Amino-3-methylbenzoic acid manufacturers

4-Amino-3-methylbenzoic acid Basic information
Product Name:4-Amino-3-methylbenzoic acid
Synonyms:Benzoic acid, 4-amino-3-methyl-;RARECHEM AL BO 2396;3-METHYL-4-AMINOBENZOIC ACID;4-AMINO-M-TOLUIC ACID;4-AMINO-3-METHYL BENZOATE;4-AMINO-3-METHYLBENZOIC ACID;4-AMINO-3-METHYLBENZENECARBOXYLIC ACID;Benzoic acid, 4-amino-3-methyl- (9CI)
CAS:2486-70-6
MF:C8H9NO2
MW:151.16
EINECS:219-629-9
Product Categories:Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts;pharmacetical;Organic acids;Acids & Esters;Anilines, Amides & Amines;Aromatic Amino Acids;Peptide Synthesis;Unnatural Amino Acid Derivatives;CARBOXYLICACID;FINE Chemical & INTERMEDIATES;Amines;blocks;Carboxes
Mol File:2486-70-6.mol
4-Amino-3-methylbenzoic acid Structure
4-Amino-3-methylbenzoic acid Chemical Properties
Melting point 169-171 °C (lit.)
Boiling point 273.17°C (rough estimate)
density 1.2023 (rough estimate)
refractive index 1.5810 (estimate)
storage temp. Keep in dark place,Inert atmosphere,Room temperature
solubility DMSO (Slightly), Methanol (Slightly)
form Solid
pka4.93±0.10(Predicted)
color Pale Brown to Light Brown
BRN 2802615
Stability:Light Sensitive
InChIInChI=1S/C8H9NO2/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4H,9H2,1H3,(H,10,11)
InChIKeyNHFKECPTBZZFBC-UHFFFAOYSA-N
SMILESC(O)(=O)C1=CC=C(N)C(C)=C1
CAS DataBase Reference2486-70-6(CAS DataBase Reference)
NIST Chemistry Reference4-Amino-3-methylbenzoic acid(2486-70-6)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-37/39-24/25
WGK Germany 3
HazardClass IRRITANT
HS Code 29224999
MSDS Information
ProviderLanguage
3-Methyl-4-aminobenzoic acid English
SigmaAldrich English
ACROS English
ALFA English
4-Amino-3-methylbenzoic acid Usage And Synthesis
Chemical Propertiesbeige or light buff to orange
Uses4-Amino-3-methylbenzoic Acid is used in preparation of Amide-substituted Benzo[d]imidazole compounds as selective inhibitors of indoleamine-2,3-dioxygenases.
reaction suitabilityreaction type: solution phase peptide synthesis
Synthesis
3-Methyl-4-nitrobenzoic acid

3113-71-1

4-Amino-3-methylbenzoic acid

2486-70-6

At room temperature and under hydrogen atmosphere, 3-methyl-4-nitrobenzoic acid (100 g, 552.04 mmol) was dissolved in methanol (2000 mL) followed by addition of palladium carbon catalyst (5.0 g). The reaction mixture was stirred continuously at room temperature for 24 hours. Upon completion of the reaction, the solid catalyst was removed by filtration. The filtrate was concentrated under reduced pressure to give the light yellow solid product 4-amino-3-methylbenzoic acid (80 g, 96% yield).

References[1] Advanced Synthesis and Catalysis, 2010, vol. 352, # 9, p. 1451 - 1454
[2] Patent: WO2014/66795, 2014, A1. Location in patent: Paragraph 0175
[3] Journal of Organic Chemistry, 2008, vol. 73, # 21, p. 8631 - 8634
[4] Patent: CN106831460, 2017, A. Location in patent: Paragraph 0029-0059
[5] Patent: CN107501106, 2017, A. Location in patent: Paragraph 0025-0047
Tag:4-Amino-3-methylbenzoic acid(2486-70-6) Related Product Information
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