3-Bromo-4-methyl-2(1H)-pyridinone
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3-Bromo-4-methyl-2(1H)-pyridinone
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CAS No:
18368-59-7
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Formula:
C6H6BrNO
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Chemical Name:
3-Bromo-4-methyl-2(1H)-pyridinone
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Synonyms:
2(1H)-Pyridinone,3-bromo-4-methyl-;2(1H)-Pyridone,3-bromo-4-methyl-;3-Bromo-4-methyl-2(1H)-pyridinone;3-Bromo-4-methyl-2-(1H)-pyridinone;3-Bromo-4-methyl-pyridin-2-ol;3-Bromo-4-methyl-1,2-dihydropyridin-2-one;3-Bromo-4-methyl-1H-pyridin-2-one
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CAS No:
Characteristics
29.1
1
1.622±0.06 g/cm3(Predicted)
323.2±42.0 °C(Predicted)
134.5±25.9 °C
1.598
0mmHg at 25°C
3-Bromo-4-methyl-2(1H)-pyridinone Use and Manufacturing
To a mixture of Example 195; Synthesis of 3-iodo-4-methyl-1-(3-(trifluoromethoxy)phenyl)pyridin-2' HP-one; A resealable pressure vessel was charged with copper(l) iodide (0.081 g, 0.425 mmol), 1-iodo-3-(trifluoromethoxy)benzene (0.434 ml, 2.77 mmol) and 3-bromo-4- methylpyridin-2(1H)-one (0.400 g, 2.13 mmol). To the mixture was added dioxane (3 ml.) followed by N1, N2-dimethylethane-1, 2-diamine (0.092 ml, 0.851 mmol). The vessel was purged with Argon, sealed, and heated to 1100C for 24 hrs. The mixture was cooled to RT, diluted with EtOAc and washed with water and brine. The organic fraction was adsorbed onto silica gel and purified by silica gel chromatography using 15-80% Hexanes:EtOAc to afford 3-iodo-4-methyl-1- (3-(trifluoromethoxy)phenyl)pyridin-2(1 H)-one as an off-white solid. M+H+ = 396.0.Example 2Synthesis of 3-iodo-4-methyl-1-(3-(trifluoromethoxy)phenyl)pyridin-2(1 H)- one Example 193; Synthesis of Example 1Synthesis of
Computed Properties
Molecular Weight:188.02
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:186.96328
Monoisotopic Mass:186.96328
Topological Polar Surface Area:29.1
Heavy Atom Count:9
Complexity:205
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-Bromo-4-methyl-2(1H)-pyridinone
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