443009 Determining the Octanol-Water Partition Coefficient of N-Nitrosodimethylamine

Monday, November 9, 2015
Exhibit Hall 1 (Salt Palace Convention Center)
Connor Ladner, Mississippi State University, Starkville, MS

N-Nitrosodimethylamine (NDMA) is a semi-volatile environmental contaminant that affects groundwater resources. Accurate measurement of the octanol-water partition coefficient plays an important role in the prediction of the environmental impact of the pollutant. The present study involves the prediction of octanol-water partition coefficient of NDMA by molecular simulation.

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