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:11
Name:4-Tert-butylphenol
Description:InChI code was generated with JChem for Excel
Labels:
CAS:98-54-4
InChi Code:InChI=1S/C10H14O/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7,11H,1-3H3

Properties

Mechanism: Mechanism of aquatic toxicity i

ValueSource or prediction
N

experimental value

N

Eq4: Model for toxicants (Training set)

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