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: | 116 | |
|---|---|---|
| Name: | 1-ethyl-1H-1,2,3-benzotriazole | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 1-Ethylbenzotriazole | |
| Labels: | ||
| CAS: | 16584-05-7 | |
| InChi Code: | InChI=1S/C8H9N3/c1-2-11-8-6-4-3-5-7(8)9-10-11/h3-6H,2H2,1H3 |
Properties
M17.logKow: The octanol-water partition coefficient as log(Kow)
| Value | Source or prediction |
|---|---|
| 1.58 |
experimental value |
| 1.4511 |
Tab2.Model_17: (B)TAZ logKow (Training set) |