PHENOLS III. THE PREPARATION OF SOME NEW SUBSTITUTED CRESOLS.1
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چکیده
منابع مشابه
QSAR of toxicology of substituted phenols
The quantitative structure activity relationship paradigm provides an excellent avenue for investigating ligand–receptor interactions in medicinal chemistry/toxicology. Lateral validation of models formulated using this approach allows for a cohesive understanding of the mechanistic underpinnings of a specific class of related molecules. The diverse biological activities of substituted phenols ...
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15 صفحه اولBacterial O-methylation of halogen-substituted phenols.
Two strains of bacteria capable of carrying out the O-methylation of phenolic compounds, one from the gram-positive genus Rhodococcus and one from the gram-negative genus Acinetobacter, were used to examine the O-methylation of phenols carrying fluoro-, chloro-, and bromo-substituents. Zero-order rates of O-methylation were calculated from data for the chloro- and bromophenols; there was no sim...
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The CBS-QB3 method was used to calculate the gas-phase free energy difference between 20 phenols and their respective anions, and the CPCM continuum solvation method was applied to calculate the free energy differences of solvation for the phenols and their anions. The CPCM solvation calculations were performed on both gas-phase and solvent-phase optimized structures. Absolute pK(a) calculation...
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The dissociation constants of the following substituted phenols in 50 wt percent methanol have been measured at 25 °C: o-nitrophenol, p-nitrophenol, 4-methyl-2-nitrophenol, 2,6-di chlorophenol , pentachlorophenol. The respective values found, expressed as pK values, are 7.91" 7.692 , 8.28" 7.680 , and 5.27.. The dissociation cons tants of 4-methyl-2-nitrophenol and pentachlorophenol, again exp ...
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ژورنال
عنوان ژورنال: Journal of the American Chemical Society
سال: 1915
ISSN: 0002-7863,1520-5126
DOI: 10.1021/ja02173a007