S. Yalkowsky, P. Myrdal, R. Dannenfelser
May 1, 1994
Citations
1
Influential Citations
12
Citations
Journal
Chemosphere
Abstract
Abstract The twelve chlorobenzenes are used to evaluate the previously described UPPER scheme. Twenty-one physical properties are calculated strictly from molecular structure with no adjustable or fitted parameters and compared with experimental values. The UPPER scheme does reasonably well with estimating all of the considered properties.