10967/168 - QDB Compounds

QsarDB Repository

Ren, S.; Schultz, T. W. Identifying the mechanism of aquatic toxicity of selected compounds by hydrophobicity and electrophilicity descriptors. Toxicol. Lett. 2002, 129, 151–160.

Compound

ID:60
Name:3-Nitrotoluene
Description:InChI code was generated with JChem for Excel
Labels:
CAS:99-08-1
InChi Code:InChI=1S/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3

Properties

Mechanism: Mechanism of aquatic toxicity i

ValueSource or prediction
R

experimental value

R

Eq4: Model for toxicants (Training set)

Links to External Resources