Piir, G.; Sild, S.; Roncaglioni, A.; Benfenati, E.; Maran, U. QSAR model for the prediction of bio-concentration factor using aqueous solubility and descriptors considering various electronic effects. SAR QSAR Environ. Res. 2010, 21, 7-8, 711-729.
Compound
| ID: | e177 | |
|---|---|---|
| Name: | triphenyl phosphite | |
| Description: | ||
| Labels: | Validation, 2 | |
| CAS: | 101-02-0 | |
| InChi Code: | InChI=1S/C18H15O3P/c1-4-10-16(11-5-1)19-22(20-17-12-6-2-7-13-17)21-18-14-8-3-9-15-18/h1-15H |
Properties
LogBCF: Fish bioconcentration factor as logBCF
| Value | Source or prediction |
|---|---|
| 2.39 |
experimental value |
| 2.6140 |
Tab2: Multilinear model for diverse chemicals (External validation set 2) |
| 2.6140 |
Tab3: Multilinear model for diverse chemicals (Tab3*, statistical outliers (Tab4) removed) (External validation set 2) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID0026252 | US EPA CompTox Dashboard |