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: | 665 | |
|---|---|---|
| Name: | 9,10-dihydroanthracene-9,10-dione | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 9,10-Anthracenedione | |
| Labels: | ||
| CAS: | 84-65-1 | |
| InChi Code: | InChI=1S/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H |
Properties
M2.logKoc: Soil sorption coefficient as log(Koc) i
| Value | Source or prediction |
|---|---|
| 3.57 |
experimental value |
| 2.5563 |
Tab2.Model_2: logKoc (Training set) |