Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.
Compound
| ID: | 1183 | |
|---|---|---|
| Name: | decylbenzene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Decyl benzene | |
| Labels: | ||
| CAS: | 104-72-3 | |
| InChi Code: | InChI=1S/C16H26/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h9,11-12,14-15H,2-8,10,13H2,1H3 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 0.630825461 |
experimental value |
| 1.0814 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID5051529 | US EPA CompTox Dashboard |