Environ. Sci. Technol., 35 (20), 4089 -4096, 2001. 10.1021/es010880x S0013-936X(01)00880-X
Web Release Date: September 18, 2001

Copyright © 2001 American Chemical Society

Tracer-Grade Rhodamine WT: Structure of Constituent Isomers and Their Sorption Behavior

Dharni Vasudevan,* Ryan L. Fimmen, and Alex B. Francisco

Nicholas School of the Environment, Duke University, Durham, North Carolina 27708-0328

Received for review April 20, 2001

Revised manuscript received August 2, 2001

Accepted August 2, 2001

Abstract:

Rhodamine WT (RWT), a fluorescent xanthene dye, is often used as a conservative tracer in aquifer characterization and as a surrogate or sorbing tracer for contaminant fate and transport. Quantitative tracing employing RWT is confounded by the presence of two major fluorescent constituents in the tracer-grade mixture. Here, we have confirmed that the two constituents are isomers of RWT, elucidated their molecular structures and their percent mass distribution in the tracer-grade mixture, and examined their individual sorption behavior onto soil solids. The energy-minimized geometry of the meta isomer indicates that it possesses a greater potential for (i) hydrophobic exclusion from bulk solution, (ii) electrostatic attraction to the solid phase, and (iii) surface complexation with surface-bound Al and Fe ions as compared with the para isomer. Hence, the meta isomer consistently sorbs to a higher extent onto the mineral phases examined. The para isomer has the potential to be a nearly conservative tracer, and the meta isomer has the potential to be a nonconservative tracer. To facilitate RWT use as a conservative tracer and comparison of tracer tests at different locations, we recommend modification of the RWT manufacturing process toward production of 100% of the para isomer. Alternatively, appropriately designed tests with tracer-grade RWT have the potential for simultaneous estimation of hydraulic parameters and contaminant fate and transport.


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