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: | 958 | |
|---|---|---|
| Name: | {[1,1'-biphenyl]-4-yl}methanol | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 4-Biphenylmethanol | |
| Labels: | ||
| CAS: | 3597-91-9 | |
| InChi Code: | InChI=1S/C13H12O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10H2 |
Properties
M2.logKoc: Soil sorption coefficient as log(Koc) i
| Value | Source or prediction |
|---|---|
| 2.59 |
experimental value |
| 3.1216 |
Tab2.Model_2: logKoc (Training set) |