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:390
Name:Octafluorocyclobutane
Description:
Labels:
CAS:115-25-3
InChi Code:InChI=1S/C4F8/c5-1(6)2(7,8)4(11,12)3(1,9)10

Properties

logSobs: Aqueous solubility as logS [mol/L]

ValueSource or prediction
-3.92

experimental value

-1.24

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

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