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: | 1040 | |
|---|---|---|
| Name: | [(R)-ethoxy({4-[(R)-methanesulfinyl]-3-methylphenoxy})phosphoryl](propan-2-yl)amine | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: Fenamiphos Sulfoxide | |
| Labels: | ||
| CAS: | 31972-43-7 | |
| InChi Code: | InChI=1S/C13H22NO4PS/c1-6-17-19(15,14-10(2)3)18-12-7-8-13(20(5)16)11(4)9-12/h7-10H,6H2,1-5H3,(H,14,15)/t19-,20-/m1/s1 |
Properties
M2.logKoc: Soil sorption coefficient as log(Koc) i
| Value | Source or prediction |
|---|---|
| 1.57 |
experimental value |
| 2.7702 |
Tab2.Model_2: logKoc (Training set) |