10967/192 - QDB Compounds

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Kim, S.-J.; Lee, H.; Kwon, J.-H. Measurement of partition coefficients for selected polycyclic aromatic hydrocarbons between isolated plant cuticles and water. Sci. Total Environ. 2014, 494-495, 113–118.

Compound

ID:9
Name:Dibenz[a,h]anthracene
Description:Measured in adaxial layer
Labels:
CAS:53-70-3
InChi Code:InChI=1S/C22H14/c1-3-7-19-15(5-1)9-11-17-14-22-18(13-21(17)19)12-10-16-6-2-4-8-20(16)22/h1-14H

Properties

logKcutw: Plant cuticles/water partition coefficient as logKcutw [L/kg(cut)]

ValueSource or prediction
7.55

Kim, S.-J.; Lee, H.; Kwon, J.-H. Measurement of partition coefficients for selected polycyclic aromatic hydrocarbons between isolated plant cuticles and water. Sci. Total Environ. 2014, 494-495, 113–118. https://doi.org/10.1016/j.scitotenv.2014.06.119

7.47

Eq.5: Model for polycyclic aromatic hydrocarbons (Training set)

7.1

Eg.6: Model for nonionic organic chemicals (Training set)

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