(6-Chloro-pyridin-2-yl)-acetonitrile
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(6-Chloro-pyridin-2-yl)-acetonitrile
structure -
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CAS No:
75279-60-6
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Formula:
C7H5ClN2
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Chemical Name:
(6-Chloro-pyridin-2-yl)-acetonitrile
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Synonyms:
(6-Chloro-pyridin-2-yl)-acetonitrile;2-(6-chloropyridin-2-yl)acetonitrile
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CAS No:
(6-Chloro-pyridin-2-yl)-acetonitrile Use and Manufacturing
To a solution of acetonitrile (2.77 mL) in tetrahydrofuran (80 mL) was added dropwise n-butyl lithium hexane solution (1.6 M, 29.6 mL) at -78°C, and the reaction mixture was stirred at -78°C for 1 hr under argon atmosphere. A solution of 2, 6-dichloropyridine (2.0 g) in tetrahydrofuran (10 mL) was added dropwise thereto at -78°C, and the reaction mixture was stirred at -78°C for 2 hr under argon atmosphere, and allowed to be warmed to room temperature. To the reaction mixture was added water, and the mixture was extracted with ethyl acetate. The extract was washed with water and saturated brine, and dried over anhydrous sodium sulfate, and the solvent was evaporated under reduced pressure. The residue was purified by silica gel column chromatography (ethyl acetate/hexane) to give the title compound (1.91 g). To a cold solution of Intermediate BY (1.0 mmol) in DMSO (10 mL) at 0 °C was added sodium cyanide (2.0 mmol) portionwise over 15 minutes. After the addition was complete, the reaction mixture was allowed to stir at 10 °C for 2 hours. Ice cold water was added to the reaction mixture (30 mL), and the mixture was extracted with ethyl acetate (3
Computed Properties
Molecular Weight:152.58
XLogP3:1.5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:152.0141259
Monoisotopic Mass:152.0141259
Topological Polar Surface Area:36.7
Heavy Atom Count:10
Complexity:149
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(6-Chloro-pyridin-2-yl)-acetonitrile
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