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4-Methyl-pyridine-2-carboxylic acid

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4-Methyl-pyridine-2-carboxylic acid Basic information
Product Name:4-Methyl-pyridine-2-carboxylic acid
Synonyms:4-Methylpyridine-2-carboxylic acid 97%;4-Methylpicolinic acid ,97%;4-Methylpyridine-2-carboxylic acid ,97%;4-Methylpicolinic acid, 2-Carboxy-4-methylpyridine;2-Pyridinecarboxylic acid, 4-methyl-;RARECHEM AL BO 2389;4-Methylpicolinicaci;4-Methy4-Methylpyridine-2-carboxylic acidlpyridine-2-carboxylic acid
CAS:4021-08-3
MF:C7H7NO2
MW:137.14
EINECS:
Product Categories:Carboxylic Acids;C7 and C8;Heterocyclic Building Blocks;Heterocyclic Compounds;pharmacetical;Pyridine series;Carboxylic Acids;Pyridines
Mol File:4021-08-3.mol
4-Methyl-pyridine-2-carboxylic acid Structure
4-Methyl-pyridine-2-carboxylic acid Chemical Properties
Melting point 137-141 °C
Boiling point 307.4±22.0 °C(Predicted)
density 1.230±0.06 g/cm3(Predicted)
storage temp. Keep in dark place,Sealed in dry,Room Temperature
form powder to crystal
pka1.11±0.50(Predicted)
color White to Light yellow
InChI1S/C7H7NO2/c1-5-2-3-8-6(4-5)7(9)10/h2-4H,1H3,(H,9,10)
InChIKeyCMMURVLHXMNTHY-UHFFFAOYSA-N
SMILESCc1ccnc(c1)C(O)=O
CAS DataBase Reference4021-08-3(CAS DataBase Reference)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-36/37/39-24/25
WGK Germany 3
Hazard Note Irritant
HS Code 29333990
Storage Class11 - Combustible Solids
MSDS Information
4-Methyl-pyridine-2-carboxylic acid Usage And Synthesis
Chemical PropertiesWhite to light brown solid
Uses4-Methylpyridine-2-carboxylic acid is a used in biological studies for the mutasynthesis of potential neuroprotectant derivatives of the bipyridyl collismycin A.
Synthesis
2-CYANO-4-METHYLPYRIDINE

1620-76-4

4-METHYL-PYRIDINE-2-CARBOXYLIC ACID

4021-08-3

General procedure for the synthesis of 4-methylpyridine-2-carboxylic acid from 2-cyano-4-methylpyridine: 2-cyano-4-methylpyridine (0.15 g, 1.27 mmol) was dissolved in about 10 mL of 6 M hydrochloric acid and heated and refluxed for 24 hours. During the reaction, the solution gradually changed from the initial pale yellow color to clear. Upon completion of the reaction, the solution was evaporated to dryness to give a white solid product. Purification by recrystallization from a minimal amount of distilled water resulted in 148 mg (85% yield) of 4-methylpyridine-2-carboxylic acid. The product was characterized by 1H NMR (DMSO-d6): δ = 8.65 (1H, s), 8.06 (1H, s), 7.66 (1H, s), 2.05 (3H, s).

References[1] Patent: WO2008/17855, 2008, A1. Location in patent: Page/Page column 49
[2] Patent: US5219847, 1993, A
[3] Advanced Synthesis and Catalysis, 2013, vol. 355, # 5, p. 947 - 956
[4] Patent: US6251919, 2001, B1
Tag:4-Methyl-pyridine-2-carboxylic acid(4021-08-3) Related Product Information
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