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: | 214 | |
|---|---|---|
| Name: | 1-bromo-3-(3-bromophenoxy)benzene | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 3,3'-biBDE | |
| Labels: | ||
| CAS: | 6903-63-5 | |
| InChi Code: | InChI=1S/C12H8Br2O/c13-9-3-1-5-11(7-9)15-12-6-2-4-10(14)8-12/h1-8H |
Properties
M11.pPL: Subcooled liquid vapour pressure as log(1/PL) [-log(Pa)] i
| Value | Source or prediction |
|---|---|
| 1.8 |
experimental value |
| 1.8863 |
Tab2.Model_11: BFR vapor pressure (Training set) |