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:48
Name:Isopropylbenzene
Description:InChI code was generated with JChem for Excel
Labels:
CAS:98-82-8
InChi Code:InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3

Properties

Mechanism: Mechanism of aquatic toxicity i

ValueSource or prediction
N

experimental value

N

Eq4: Model for toxicants (Training set)

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