ChemicalBook--->CAS DataBase List--->31872-65-8

31872-65-8

31872-65-8 Structure

31872-65-8 Structure
IdentificationBack Directory
[Name]

3-Bromo-4-hydroxy-5-nitropyridine
[CAS]

31872-65-8
[Synonyms]

3-broMo-5-nitro-4-pyridone
5-BroM-3-nitro-4-pyridinol
3-Bromo-5-nitro-4-pyridinol
4-Pyridinol, 3-broMo-5-nitro-
3-Bromo-4-hydroxy-5-nitropyridine
4-Hydroxy-3-nitro-5-broMopyridine
3-Bromo-4-hydroxy-5-nitropyridine ISO 9001:2015 REACH
[Molecular Formula]

C5H3BrN2O3
[MDL Number]

MFCD08692339
[MOL File]

31872-65-8.mol
[Molecular Weight]

219
Chemical PropertiesBack Directory
[Boiling point ]

341.8±37.0 °C(Predicted)
[density ]

2.006±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

powder to crystal
[pka]

-1.63±0.38(Predicted)
[color ]

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

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
[Hazard Codes ]

Xn
[Risk Statements ]

22
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

2933399990
Spectrum DetailBack Directory
[Spectrum Detail]

3-Bromo-4-hydroxy-5-nitropyridine(31872-65-8)1HNMR
Hazard InformationBack Directory
[Synthesis]

4-Hydroxy-3-nitropyridine

5435-54-1

3-Bromo-4-hydroxy-5-nitropyridine

31872-65-8

Step 1. Synthesis of 3-bromo-5-nitropyridin-4-ol To a suspension of 4-hydroxy-3-nitropyridine (7.00 g, 50 mmol) in water (50 mL), bromine (3.23 mL, 63 mmol) was added slowly and dropwise at room temperature. The reaction mixture was stirred at room temperature for 1 hour, followed by heating to 50 °C and maintained for 2 hours. Upon completion of the reaction, the mixture was cooled to room temperature and stirring was continued for 1 hour. The solid product was collected by filtration, washed well with water and dried under vacuum for 2 days to afford 3-bromo-5-nitropyridin-4-ol 9.54 g in 87% yield.

[References]

[1] Patent: WO2005/37198, 2005, A2. Location in patent: Page/Page column 26
[2] Patent: WO2006/38773, 2006, A1. Location in patent: Page/Page column 57
[3] Patent: WO2005/37198, 2005, A2. Location in patent: Page/Page column 26
[4] Tetrahedron Letters, 2012, vol. 53, # 4, p. 377 - 379
[5] Journal of Medicinal Chemistry, 2014, vol. 57, # 6, p. 2462 - 2471
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