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886365-56-6

886365-56-6 Structure

886365-56-6 Structure
IdentificationBack Directory
[Name]

5-FLUORO-3-METHYL-PYRIDIN-2-YLAMINE
[CAS]

886365-56-6
[Synonyms]

2-AMINO-5-FLUORO-3-PICOLINE
5-Fluoro-3-methylpyridin-2-amine
5-fluoro-3-Methyl-2-pyridinaMine
2-Amino-5-fluoro-3-methylpyridine
2-Pyridinamine, 5-fluoro-3-methyl-
5-FLUORO-3-METHYL-PYRIDIN-2-YLAMINE
5-FLUORO-3-METHYL-PYRIDIN-2-YLAMINE ISO 9001:2015 REACH
[Molecular Formula]

C6H7FN2
[MDL Number]

MFCD07375130
[MOL File]

886365-56-6.mol
[Molecular Weight]

126.13
Chemical PropertiesBack Directory
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[form ]

solid
[color ]

Cream
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H332-H335
[Precautionary statements ]

P261-P280-P305+P351+P338
[Hazard Codes ]

Xn
[Risk Statements ]

22-37/38-41
[Safety Statements ]

26-39
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

5-FLUORO-3-METHYL-PYRIDIN-2-YLAMINE(886365-56-6)1HNMR
Hazard InformationBack Directory
[Synthesis]

2-Chloro-5-fluoro-3-methylpyridine

38186-84-4

5-FLUORO-3-METHYL-PYRIDIN-2-YLAMINE

886365-56-6

To a solution of 2-chloro-3-methyl-5-fluoropyridine (0.50 g, 2.82 mmol) in anhydrous toluene (12.5 mL) was added sequentially sodium tert-butoxide (0.462 g, 4.81 mmol), tris(dibenzylideneacetone)dipalladium (0.315 g, 0.344 mmol), 2,2'-bis(diphenylphosphinato)-1,1'-binaphthyl ( BINAP, 0.642 g, 1.031 mmol) and benzophenoneimine (0.692 mL, 4.12 mmol). The reaction mixture was degassed (three evacuation/nitrogen filling cycles) and subsequently heated to 80 °C and stirred for 1 hour. Upon completion of the reaction, the mixture was cooled to room temperature, diluted with ether (400 mL) and filtered through a pad of diatomaceous earth. The filtrate was concentrated under reduced pressure and the residue was dissolved in tetrahydrofuran (34 mL) and 2 M aqueous hydrochloric acid (1.408 mL, 2.82 mmol) was added. After stirring for 1.5 h at room temperature, the reaction mixture was neutralized with saturated aqueous sodium bicarbonate and diluted with dichloromethane (200 mL). The aqueous phase was back-extracted with dichloromethane (2 x 50 mL). The organic phases were combined, dried with anhydrous sodium sulfate, filtered and concentrated under reduced pressure. The residue was purified by rapid chromatography on silica gel (Biotage SP4 12M, cyclohexane/ethyl acetate 60/40). The target fraction was collected to give 2-amino-3-methyl-5-fluoropyridine (0.20 g, 1.554 mmol, 55.2% overall yield in two steps) as an orange solid. Mass spectrum (electrospray positive ion mode) m/z: 127 ([M+H]+). Elemental analysis calculated value (C6H7FN2): 126.1. 1H NMR (400 MHz, DMSO-d6) δ (ppm): 7.73 (d, 1H), 7.23 (dd, 1H), 5.60 (broad peak, 2H), 2.04 (s, 3H).

[References]

[1] Patent: US2009/22670, 2009, A1. Location in patent: Page/Page column 20
[2] Patent: WO2010/72722, 2010, A1. Location in patent: Page/Page column 27
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