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:	1695
	Name:	2-hydroxy-3-methoxybenzaldehyde
	Description:	IUPAC names and InChI codes were generated with InstantJChem Original name was: o-Vanillin
	Labels:
	CAS:	148-53-8
	InChi Code:	InChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-9)8(7)10/h2-5,10H,1H3

Properties

M1.pLC50: 96-h Fathead minnow toxicity as log(1/LC50) [-log(mol/L)]

Value	Source or prediction
4.8	experimental value
4.1054	Tab2.Model_1: P. promelas LC50 (Training set)

Links to External Resources

Link	Resource description
DTXSID5022011	US EPA CompTox Dashboard