ChemicalBook--->CAS DataBase List--->4253-81-0

4253-81-0

4253-81-0 Structure

4253-81-0 Structure
IdentificationBack Directory
[Name]

2-(2-Nitrophenyl)pyridine
[CAS]

4253-81-0
[Synonyms]

2-(2-Nitrophenyl)pyridine
Pyridine, 2-(2-nitrophenyl)-
[Molecular Formula]

C11H8N2O2
[MDL Number]

MFCD00956747
[MOL File]

4253-81-0.mol
[Molecular Weight]

200.19
Chemical PropertiesBack Directory
[storage temp. ]

Inert atmosphere,Room Temperature
Hazard InformationBack Directory
[Synthesis]

2-Bromopyridine

109-04-6

2-Nitrophenylboronic acid

5570-19-4

2-(2-Nitrophenyl)pyridine

4253-81-0

To a 170 mL suspension of DME/EtOH/H2O (4:1:1) containing K2CO3 (4.65 g, 33.6 mmol), Pd(OAc)2 (0.189 g, 0.840 mmol), and PPh3 (0.882 g, 3.36 mmol), was added sequentially 2-nitrophenylboronic acid (3.37 g, 20.2 mmol) and 2-bromopyridine (1.60 mL, 16.8 mmol). The reaction mixture was stirred at 70 °C overnight and concentrated under reduced pressure. Water (100 mL) and Et2O (100 mL) were added to the concentrated residue and the aqueous layer was extracted with Et2O (50 mL x 2). The combined organic layers were washed with brine (50 mL), dried over Na2SO4 and the solvent evaporated. The residue was purified by silica gel column chromatography (eluent: hexane/EtOAc = 6:1) to afford 2-(2-nitrophenyl)pyridine (2.23 g, 66% yield) as a white solid. The spectral data of the product were in agreement with literature reports: rf = 0.28 (hexane/EtOAc = 2:1); 1H NMR (400 MHz, CDCl3): δ 8.66 (d, J = 5.0 Hz, 1H), 7.91 (d, J = 8.2 Hz, 1H), 7.81 (dd, J = 7.7, 7.7 Hz, 1H), 7.68 (d, J = 7.2 Hz, 1H), 7.63 (dd, J = 7.7, 7.7 Hz, 1H), 7.55 (dd, J = 7.7, 7.2 Hz, 1H), 7.48 (d, J = 8.2 Hz, 1H), 7.32 (dd, J = 7.7, 5.0 Hz, 1H).

[References]

[1] Heterocycles, 2014, vol. 8, # 2, p. 1539 - 1551
[2] Patent: WO2009/58348, 2009, A1. Location in patent: Page/Page column 83
[3] Patent: CN108530490, 2018, A. Location in patent: Paragraph 0086; 0087; 0088; 0089
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