10967/188 - QDB Compounds

QsarDB Repository

Ran, Y.; He, Y.; Yang, G.; Johnson, J. L. H.; Yalkowsky, S. H. Estimation of aqueous solubility of organic compounds by using the general solubility equation. Chemosphere 2002, 48, 487–509.

Compound

ID:264
Name:9-Anthracenol
Description:Name was changed from 1-Anthranol to 9-Anthracenol
Labels:
CAS:529-86-2
InChi Code:InChI=1S/C14H10O/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9,15H

Properties

logSobs: Aqueous solubility as logS [mol/L]

ValueSource or prediction
-4.73

experimental value

-4.65

Eq.1: General solubility equation (Test set to verify GSE)

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