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:248
Name:Fluorene
Description:
Labels:
CAS:86-73-7
InChi Code:InChI=1S/C13H10/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-8H,9H2

Properties

MlogP: Measured octanol/water partition coefficient as logP

ValueSource or prediction
4.18

experimental value

logSobs: Aqueous solubility as logS [mol/L]

ValueSource or prediction
-4.91

experimental value

-4.48

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

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