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: | 1323 | |
|---|---|---|
| Name: | 1,3-dibromo-2,2-bis(bromomethyl)propane | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Propane. 1.3-dibromo-2.2-bis(bromomethyl)- | |
| Labels: | ||
| CAS: | 3229-00-3 | |
| InChi Code: | InChI=1S/C5H8Br4/c6-1-5(2-7,3-8)4-9/h1-4H2 |
Properties
M5.logHLn: Biotransformation half-lives in fish
| Value | Source or prediction |
|---|---|
| 0.755825461 |
experimental value |
| 0.6855 |
Tab2.Model_5: Metab. biotransf. fish (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID1062916 | US EPA CompTox Dashboard |