2-Methyl-5-nitronicotinic acid

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2-Methyl-5-nitronicotinic acid Basic information
Product Name:2-Methyl-5-nitronicotinic acid
Synonyms:2-Methyl-5-nitro-3-pyridinecarboxylic acid;3-Pyridinecarboxylicacid, 2-Methyl-5-nitro-;2-methyl-5-nitropyridine-3-carboxylic acid;IFLAB-BB F2124-0617;2-Methyl-5-nitronicotinic acid
CAS:59290-81-2
MF:C7H6N2O4
MW:182.13
EINECS:
Product Categories:Heterocycle-Pyridine series
Mol File:59290-81-2.mol
2-Methyl-5-nitronicotinic acid Structure
2-Methyl-5-nitronicotinic acid Chemical Properties
Melting point 215-215.5 °C
Boiling point 370.1±42.0 °C(Predicted)
density 1.477±0.06 g/cm3(Predicted)
storage temp. Sealed in dry,Room Temperature
pka2.47±0.10(Predicted)
AppearanceLight brown to brown Solid
Safety Information
Hazard Codes Xi
HazardClass IRRITANT
MSDS Information
2-Methyl-5-nitronicotinic acid Usage And Synthesis
Synthesis
ETHYL 2-METHYL-5-NITRONICOTINATE

51984-71-5

2-METHYL-5-NITRONICOTINIC ACID

59290-81-2

General procedure for the synthesis of 2-methyl-5-nitronicotinic acid from ethyl 2-methyl-5-nitronicotinate: compound D4 (300 g, 1.4 mol) was dissolved in a mixture of 800 mL hydrochloric acid and 800 mL water. The reaction mixture was heated under reflux conditions for 1 hour. Upon completion of the reaction, it was cooled to room temperature, the reaction solution was diluted with 2.0 L of water and slowly neutralized with the addition of solid sodium bicarbonate to pH=5.0. During this process, a precipitate was gradually formed. The mixture was further cooled and the precipitate was collected by filtration. After drying, brown solid D5 (223 g, 85.7% yield) was obtained. The product was characterized by 1H NMR (DMSO-d6, 300 MHz): δ = 2.84 (s, 3H), 8.74-8.75 (d, 1H), 9.35-9.36 (d, 1H), 13.90 (s, 1H).LC-MS analysis showed that the [M-1]+ peak was located at 180.9.

References[1] Patent: WO2008/88881, 2008, A1. Location in patent: Page/Page column 33-34
[2] Journal of the American Chemical Society, 1953, vol. 75, p. 737
[3] Patent: WO2007/56016, 2007, A2. Location in patent: Page/Page column 105
2-Methyl-5-nitronicotinic acid Preparation Products And Raw materials
Raw materialsEthyl 2-methyl-5-nitronicotinate
Preparation Productstert-Butyl (6-Methyl-5-nitropyridin-3-yl)carbaMate
Tag:2-Methyl-5-nitronicotinic acid(59290-81-2) Related Product Information
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