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: | 1545 | |
|---|---|---|
| Name: | 1,3-dimethylnaphthalene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Di-Me & Et naphthalenes | |
| Labels: | ||
| CAS: | ||
| InChi Code: | InChI=1S/C12H12/c1-9-7-10(2)12-6-4-3-5-11(12)8-9/h3-8H,1-2H3 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 0.680825461 |
experimental value |
| 0.314 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID9060360 | US EPA CompTox Dashboard |