10967/180 - QDB Compounds

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Papa, E.; Gramatica, P. QSPR as a support for the EU REACH regulation and rational design of environmentally safer chemicals: PBT identification from molecular structure. Green Chem. 2010, 12, 836-843.

Compound

ID:107
Name:chloro(methoxy)methane
Description:
Labels:Training
CAS:107-30-2
InChi Code:InChI=1S/C2H5ClO/c1-4-2-3/h2H2,1H3

Properties

PBT_Index: PBT Index i

ValueSource or prediction
-2.05

experimental value

-0.86

Eq1: Full Model (Training set)

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