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:50
Name:Butylbenzene
Description:InChI code was generated with JChem for Excel
Labels:
CAS:104-51-8
InChi Code:InChI=1S/C10H14/c1-2-3-7-10-8-5-4-6-9-10/h4-6,8-9H,2-3,7H2,1H3

Properties

Mechanism: Mechanism of aquatic toxicity i

ValueSource or prediction
N

experimental value

N

Eq4: Model for toxicants (Training set)

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