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87032-82-4

87032-82-4 Structure

87032-82-4 Structure
IdentificationBack Directory
[Name]

3-hydroxypyridine-4-carbonitrile
[CAS]

87032-82-4
[Synonyms]

4-Cyano-3-hydroxypyridine
3-Hydroxyisonicotinonitrile
3-hydroxy-4-Pyridinecarbonitrile
3-hydroxypyridine-4-carbonitrile
4-Pyridinecarbonitrile, 3-hydroxy-
6- (tert butyl aminomethyl) isonicotinic acid
3-Hydroxypyridine-4-carbonitrile, 4-Cyano-3-hydroxypyridine
[EINECS(EC#)]

604-604-1
[Molecular Formula]

C6H4N2O
[MOL File]

87032-82-4.mol
[Molecular Weight]

120.11
Chemical PropertiesBack Directory
[Melting point ]

166 °C
[Boiling point ]

393.6±27.0 °C(Predicted)
[density ]

1.33±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[pka]

5.38±0.10(Predicted)
[Appearance]

Off-white to yellow Solid
Safety DataBack Directory
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

3-hydroxypyridine-4-carbonitrile(87032-82-4)1HNMR
Hazard InformationBack Directory
[Synthesis]

4-Pyridinecarbonitrile, 3-[2-(trimethylsilyl)ethoxy]-

945989-08-2

3-hydroxypyridine-4-carbonitrile

87032-82-4

Step C: Preparation of 3-hydroxyisonicotinonitrile: 3-(2-(trimethylmethylsilyl)ethoxy)isonicotinonitrile (1.30 g, 5.90 mmol) and anhydrous THF (5 mL) were added to a dry reaction flask, followed by slow addition of ammonium fluoride (11.8 mL, 11.8 mmol) to the THF solution. The reaction mixture was stirred at room temperature for 1 h, after which the solvent was removed by concentration via rotary evaporator. The crude product was purified by silica gel column chromatography using sequentially dichloromethane and dichloromethane solution containing 5% methanol as eluents to afford the target product 3-hydroxyisonicotinonitrile (0.7 g, 99% yield) as a dark brown oil.

[References]

[1] Patent: WO2008/91770, 2008, A1. Location in patent: Page/Page column 32
[2] Patent: WO2007/89512, 2007, A1. Location in patent: Page/Page column 194
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