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Physical & Chemical properties

Partition coefficient

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Administrative data

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Reference
Endpoint:
partition coefficient
Type of information:
(Q)SAR
Adequacy of study:
key study
Study period:
23 May 2016
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Remarks:
EPISuite v4.1 (KOWWIN v 1.68)
Justification for type of information:
The test item is a solution of 29 % ammonium lauroyl sarconsinate (component 1) and 1 % ammonium Iaurate (component 2) in water.  As component 1 is surface active (surface tension of the mixture is 37.71 ± 0.19 mN/m at 20.0 °C, LAUS study No. 15121103G960) and the substance is not a pure substance, none of the experimental methods for determination of the log Pow is applicable. Therefore the log Pow for the two components is calculated using the program kowwin v1.68 (part of EPI suite 4.1, US EPA. 2011: Estimation Programs Interface Suite™ for Microsoft® Windows, v 4.10. (United States Environmental Protection Agency, Washington, DC, USA). The non-ionized form (i.e. the free acids instead of the ammonium salts) are used for calculation.
Principles of method if other than guideline:
QSAR calculation
GLP compliance:
no
Type of method:
other: QSAR
Partition coefficient type:
octanol-water
Type:
log Pow
Partition coefficient:
4.1
Remarks on result:
other: Lauroyl Sarcosinate
Remarks:
(est.) KOWWIN v1.68
Type:
log Pow
Partition coefficient:
5
Remarks on result:
other: Lauric acid
Remarks:
(est.) KOWWIN v 1.68

Results

The calculated Log Kow (using kowwin v 1.68) for Lauroyl sarcosinate is 4.10 and is 5.00 for Lauric acid.

Description of key information

Main constituent: Log Kow of Lauroyl sarcosinate is 4.10 (EPISuite v 4.10, KOWWIN v1.68).

Impurity: Log Kow of Lauric acid is 5.00 (EPISuite v 4.10, KOWWIN v1.68).

Key value for chemical safety assessment

Additional information