ID: | 460 | |
---|---|---|
Name: | 3-Bromophenylurea | |
Description: | ||
Labels: | Validation | |
CAS: | 2989-98-2 | |
InChi Code: | InChI=1/C7H7BrN2O/c8-5-2-1-3-6(4-5)10-7(9)11/h1-4H,(H3,9,10,11)/f/h10H,9H2 |
logKoc: logarithm of soil sorption coefficient i
Value | Source or prediction |
---|---|
2.1 |
experimental value |
1.87 |
Eq1: Best externally predictive model (Validation set) |
2 |
Eq2: Full model, including all data (Training set) |
2.1 |
Tab2-9: Correlation with logKow (Validation set) |
2.24 |
Tab2-10: Correlation with logSw (Validation set) |
2.23 |
Tab2-11: logKow and aromaticity (Validation set) |
2.34 |
Tab2-12: logSw and aromaticity (Validation set) |
Link | Resource description |
---|---|
DTXSID70184008 | US EPA CompTox Dashboard |