In this report, three studies are presented that utilize computations to predict transformations, identities, and properties of environmental organic molecules. Each study shows how computations can lead to models of chemical behavior. The importance of this research is rooted in the need for understanding how human behavior and health intersect...
Reaction of 4, 6-dimethoxy-5-nitropyrimidine [I], with refluxing
pyridine, was discovered to yield the methylpyridinium salt of
1, 6-dihydr -4-hydroxy-1-methyl-5-nitro-6-oxopyrimidine [III]. Possible
use of I as a general N-methylating agent was explored. No
appreciable reaction occurred between I and refluxing excess n-butyl
alcohol. Similar reaction involving quinoline failed to yield an...
Polybenzimidazoles were synthesized from 3,3'-diaminobenzidine (DAB) and dicarboxylic acids. The polymerizations using the dicarboxylic acid monomers were carried out in polyphosphoric acid (PPA) and phosphorus pentoxide/methansulfonic acid (PPMA) which acted as the solvent and condensing agent. The resulting polybenzimidazoles had inherent viscosities in the range of 0.12 to 0.84 dL/g....
Previous investigations of the biosynthesis of sterols by the
arterial wall have shown that the intact aorta is capable of low level
incorporation of labeled precursor into a sterol digitonide. The biosynthesis
of sterols and related lipids by a cell-free preparation of
bovine aorta was investigated in the present study....