5-Bromo-3-fluoro-2-(hydro...
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5-Bromo-3-fluoro-2-(hydro...
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CAS No:
1206968-92-4
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Formula:
C6H5BrFNO
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Chemical Name:
5-Bromo-3-fluoro-2-(hydro...
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Synonyms:
5-Bromo-3-fluoro-2-(hydro...;5-BroMo-3-fluoro-2-(hydroxyMethyl)pyridine;(5-broMo-3-fluoropyridin-2-yl)Methanol;(5-Bromo-3-fluoro-2-pyridyl)methanol
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CAS No:
5-Bromo-3-fluoro-2-(hydro... Use and Manufacturing
To a solution of methyl 5-bromo-3-fluoro-2-pyridinecarboxylate (12.82 mmol) in absolute ethanol (50.0 ml) was added sodium borohydride (64.1 mmol). The suspension was heated at reflux for 4 h then cooled and evaporated under reduced pressure. The resulting residue was taken into a mixture of saturated aqueous sodium bicarbonate and brine then extracted with ethyl acetate. The extracts were dried (sodium sulfate) then treated with silica powder (~3g) and evaporated to dryness. Purification by silica gel chromatography (10percent hexanes in ethyl acetate) afforded the title compound (2.27 g, 82percent) as a white solid. MS(ES)+ m/e 205.9, 207.7 [M+H]
Computed Properties
Molecular Weight:206.01
XLogP3:0.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:204.95385
Monoisotopic Mass:204.95385
Topological Polar Surface Area:33.1
Heavy Atom Count:10
Complexity:114
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes