ChemicalBook--->CAS DataBase List--->156072-86-5

156072-86-5

156072-86-5 Structure

156072-86-5 Structure
IdentificationBack Directory
[Name]

5-bromo-3-methylpicolinonitrile
[CAS]

156072-86-5
[Synonyms]

5-bromo-3-methylpicolinonitrile
5-BroMo-2-cyano-3-Methylpyridine
5-bromo-3-methyl-2-pyridinecarbonitrile
2-Pyridinecarbonitrile,5-bromo-3-methyl-
5-Bromo-2-cyano-3-methylpyridine, 5-Bromo-3-methylpicolinonitrile
[Molecular Formula]

C7H5BrN2
[MDL Number]

MFCD11975788
[MOL File]

156072-86-5.mol
[Molecular Weight]

197.03
Chemical PropertiesBack Directory
[Boiling point ]

283.6±35.0 °C(Predicted)
[density ]

1.61±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[pka]

-2.38±0.20(Predicted)
[Appearance]

White to yellow Solid
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302+H312+H332-H315-H319-H335
[Precautionary statements ]

P260-P271-P280
[RIDADR ]

2811
[HazardClass ]

6.1
[PackingGroup ]

Ⅲ
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

5-bromo-3-methylpicolinonitrile(156072-86-5)1HNMR
Hazard InformationBack Directory
[Synthesis]

2,5-Dibromo-3-methylpyridine

3430-18-0

Copper(I) Cyanide

544-92-3

5-bromo-3-methylpicolinonitrile

156072-86-5

Example 9.1: Synthesis of 5-bromo-3-methylpyridine-2-carbonitrile. To a solution of 2,5-dibromo-3-methylpyridine (2.5 g, 9.96 mmol) in dimethylformamide (10 mL) was added cuprous cyanide (892 mg, 9.96 mmol), and the reaction mixture was stirred for 12 hours at 120 °C. Upon completion of the reaction, the reaction mixture was partitioned between ethyl acetate and water. The organic layer was separated, washed with saturated aqueous sodium chloride solution, dried over anhydrous sodium sulfate, filtered and concentrated. Purification by column chromatography gave a white solid product (970 mg, 57.6% yield). Product characterization data: 1H NMR (300 MHz, CDCl3): δ 8.55 (s, 1H), 7.64 (t, 1H), 2.54 (s, 3H).

[References]

[1] Patent: WO2008/100715, 2008, A1. Location in patent: Page/Page column 33
[2] Patent: US2006/199817, 2006, A1. Location in patent: Page/Page column 27
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