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Physical & Chemical properties

Partition coefficient

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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:
other: Accepted calculation method, peer-reviewed.
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2013
Report Date:
2013

Materials and methods

Principles of method if other than guideline:
Calculation based on KOWWIN programme v1.68, Estimation Programs Interface Suite™ for Microsoft® Windows v 4.00. US EPA, United States Environmental Protection Agency, Washington, DC, USA.
For further details please see under "Any other information on materials and methods incl. tables".
GLP compliance:
no
Remarks:
Calculation
Type of method:
other: estimated by calculation
Partition coefficient type:
octanol-water

Test material

Reference
Name:
Unnamed
Type:
Constituent
Details on test material:
- Name of test material (as cited in study report): Glycerol monooleate component of Glycerides, tall-oil mono-, di- and tri-
- Molecular formula (if other than submission substance): C21H40O4
- Molecular weight (if other than submission substance): 356.55
- Smiles notation (if other than submission substance): O=C(OCC(O)C(O))CCCCCCCC=CCCCCCCCC
- Analytical purity: not applicable

Results and discussion

Partition coefficient
Type:
log Pow
Partition coefficient:
6.4
Remarks on result:
other: for C18:1 glycerol monoester

Any other information on results incl. tables

QSAR result; pH and temperature are not reported. For detailed description of the model and its applicability, see "Any other information on materials and methods incl. tables".

Applicant's summary and conclusion