Registration Dossier

Administrative data

Endpoint:
partition coefficient
Type of information:
(Q)SAR
Adequacy of study:
weight of evidence
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
This is a prediction without QPRF.

Data source

Reference
Reference Type:
other: Own company estimated data.
Title:
Unnamed
Year:
2014
Report date:
2014

Materials and methods

Principles of method if other than guideline:
QSAR was applied
Type of method:
other: QSAR was applied
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
N-(2-hydroxyethyl)phthalimide
EC Number:
223-434-4
EC Name:
N-(2-hydroxyethyl)phthalimide
Cas Number:
3891-07-4
Molecular formula:
C10H9NO3
IUPAC Name:
2-(2-hydroxyethyl)-2,3-dihydro-1H-isoindole-1,3-dione

Results and discussion

Partition coefficient
Type:
log Pow
Partition coefficient:
0.33
Temp.:
25 °C
Remarks on result:
other: Error: 0.26

Applicant's summary and conclusion

Conclusions:
The estimated partition coefficient of test item is 0.33.