ChemicalBook--->CAS DataBase List--->944799-22-8

944799-22-8

944799-22-8 Structure

944799-22-8 Structure
IdentificationBack Directory
[Name]

3,6-difluoropyridin-2-aMine
[CAS]

944799-22-8
[Synonyms]

3,6-difluoropyridin-2-aMine
2-Pyridinamine, 3,6-difluoro-
[Molecular Formula]

C5H4F2N2
[MDL Number]

MFCD13175493
[MOL File]

944799-22-8.mol
[Molecular Weight]

130.1
Chemical PropertiesBack Directory
[Boiling point ]

190.0±35.0 °C(Predicted)
[density ]

1.393±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[pka]

0.57±0.10(Predicted)
[Appearance]

Off-white to gray Solid
[InChI]

InChI=1S/C5H4F2N2/c6-3-1-2-4(7)9-5(3)8/h1-2H,(H2,8,9)
[InChIKey]

HMRIDZSIODFQSH-UHFFFAOYSA-N
[SMILES]

C1(N)=NC(F)=CC=C1F
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

3,6-difluoropyridin-2-aMine(944799-22-8)1HNMR
Hazard InformationBack Directory
[Synthesis]

2,3,6-TRIFLUOROPYRIDINE

3512-18-3

3,6-difluoropyridin-2-aMine

944799-22-8

Under argon protection, 2,3,6-trifluoropyridine (5 g, 37.59 mmol) was dissolved in 1,4-dioxane (20 mL) and stirred until completely dissolved. Subsequently, ammonia (20 mL) was slowly added to the solution. The reaction mixture was stirred continuously at 100 °C for 16 hours. The progress of the reaction was monitored by thin layer chromatography (TLC) and after confirming complete consumption of 2,3,6-trifluoropyridine, the reaction was quenched with cold water (500 mL). The reaction mixture was extracted with dichloromethane (2 x 500 mL) and the organic phases were combined. The organic phase was dried with anhydrous sodium sulfate, filtered, and concentrated under reduced pressure to afford 3,6-difluoropyridin-2-amine (3 g, 62% yield) as an off-white solid, which could be used for subsequent reactions without further purification.TLC conditions: 10% ethyl acetate/hexane (Rf: 0.5).

[References]

[1] Patent: WO2007/87549, 2007, A2. Location in patent: Page/Page column 117
[2] Patent: WO2015/109109, 2015, A1. Location in patent: Paragraph 0742
[3] Patent: US2017/44182, 2017, A1. Location in patent: Paragraph 1026
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