ISSN:
1573-9171
Source:
Springer Online Journal Archives 1860-2000
Topics:
Chemistry and Pharmacology
Notes:
Conclusions 1. For the isolated molecule of 2,6-di-tert-butyl-4-methylphenol, the most stable conformation is that in which the OH group is turned 90° relative to the phenyl ring 2. Ionol in the conformation with the deviated OH group is hydrated more strongly than when the OH group is located in the plane of the phenyl ring 3. The energies of electrostatic interaction with water give a qualitatively correct picture of the behavior of the octanol/water distribution coefficients for ionol derivatives.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1007/BF00948629
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