ID: | 170 | |
---|---|---|
Name: | Phenylacetic Acid | |
Description: | ||
Labels: | Validation | |
CAS: | 103-82-2 | |
InChi Code: | InChI=1/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)/f/h9H |
logKoc: logarithm of soil sorption coefficient i
Value | Source or prediction |
---|---|
1.5 |
experimental value |
1.8 |
Eq1: Best externally predictive model (Validation set) |
1.88 |
Eq2: Full model, including all data (Training set) |
1.68 |
Tab2-9: Correlation with logKow (Validation set) |
1.45 |
Tab2-10: Correlation with logSw (Validation set) |
1.88 |
Tab2-11: logKow and aromaticity (Validation set) |
1.62 |
Tab2-12: logSw and aromaticity (Validation set) |
Link | Resource description |
---|---|
DTXSID2021656 | US EPA CompTox Dashboard |