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:10
Name:Benzo[ghi]perylene
Description:Measured in adaxial layer
Labels:
CAS:191-24-2
InChi Code:InChI=1S/C22H12/c1-3-13-7-9-15-11-12-16-10-8-14-4-2-6-18-17(5-1)19(13)21(15)22(16)20(14)18/h1-12H

Properties

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

ValueSource or prediction
7.41

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. http://dx.doi.org/10.1016/j.scitotenv.2014.06.119

7.62

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

7.26

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

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