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Physical & Chemical properties

Partition coefficient

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Administrative data

Endpoint:
partition coefficient
Type of information:
experimental study
Adequacy of study:
key study
Study period:
Study Experimental Work 2013-03-26 to 2013-05-31. Study report complete 2013-10-10.
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
other: Meets the criteria for classification as reliable without restriction according to Klimisch et al (1997).

Data source

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

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
OECD Guideline 107 (Partition Coefficient (n-octanol / water), Shake Flask Method)
Deviations:
no
GLP compliance:
yes
Type of method:
shake-flask method to: flask method
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
lithium 3-((3,4-dicyanophenyl)thio)propane-1-sulfonate
EC Number:
700-787-7
Cas Number:
769953-18-6
Molecular formula:
C11H9N2O3S2Li
IUPAC Name:
lithium 3-((3,4-dicyanophenyl)thio)propane-1-sulfonate
Test material form:
solid: particulate/powder

Results and discussion

Partition coefficient
Type:
log Pow
Partition coefficient:
-2.32
Temp.:
25 °C
pH:
8.64 - 10.03

Applicant's summary and conclusion

Conclusions:
The Log P of this test material was determined to be -2.32 at 25 C +/-1 C in this study.
Executive summary:

Introduction

This study was undertaken to determine the Partition Coefficient of the test material. The method used was designed to be compatible with OECD Guideline 107 - Shake flask method.

Results & Conclusions

The Log P of this test material was determined to be -2.32 at 25 C +/-1 C in this study.

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