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: | 1680 | |
|---|---|---|
| Name: | 3-ethoxy-4-hydroxybenzaldehyde | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: 3-Ethoxy-4-hydroxybenzaldehyde | |
| Labels: | ||
| CAS: | 121-32-4 | |
| InChi Code: | InChI=1S/C9H10O3/c1-2-12-9-5-7(6-10)3-4-8(9)11/h3-6,11H,2H2,1H3 |
Properties
M1.pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [-log(mol/L)]
| Value | Source or prediction |
|---|---|
| 3.28 |
experimental value |
| 3.9232 |
Tab2.Model_1: P. promelas LC50 (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID5021968 | US EPA CompTox Dashboard |