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The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Administrative data

Endpoint:
partition coefficient
Type of information:
experimental study
Adequacy of study:
key study
Study period:
07 April 2015 - 29 May 2015
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
other: GLP-compliant study in accordance with EC A.8.

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2015
Report date:
2015

Materials and methods

Test guidelineopen allclose all
Qualifier:
according to guideline
Guideline:
EU Method A.8 (Partition Coefficient)
Version / remarks:
(2008)
Deviations:
no
Qualifier:
according to guideline
Guideline:
OECD Guideline 117 (Partition Coefficient (n-octanol / water), HPLC Method)
Version / remarks:
(2004)
Deviations:
no
Qualifier:
according to guideline
Guideline:
EPA OPPTS 830.7570 (Partition Coefficient, n-octanol / H2O, Estimation by Liquid Chromatography)
Version / remarks:
(1996)
Deviations:
no
GLP compliance:
yes
Type of method:
HPLC method
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1-thiol
EC Number:
628-448-8
Cas Number:
34451-26-8
Molecular formula:
C8H5F13S
IUPAC Name:
3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctane-1-thiol
Details on test material:
- Name (as cited in study report): NS-1000
- Appearance: Clear colourless liquid

Results and discussion

Partition coefficient
Type:
log Pow
Partition coefficient:
5.3
pH:
7
Remarks on result:
other: Pow = 1.8 E05
Details on results:
In the chromatogram of the test substance solution, one peak with a retention time of 5.0 minutes was observed. No substance related peak was observed in the chromatogram of the test substance blank.

Any other information on results incl. tables

Table: Results HPLC method for partition coefficient n-octanol-water:

 

Substance

tr,1

[min.]

tr,2

[min.]

Mean tr

[min.]

Log Pow

Pow

Formamide (t0)

0.674

0.676

0.675

 

 

1,4-Dichlorobenzene

1.845

1.839

 

3.4

Biphenyl

2.442

2.436

4.0

1,2,4-Trichlorobenzene

2.805

2.798

4.2

Dibenzyl

3.964

3.957

4.8

Triphenylamine

7.173

7.167

5.7

4,4’-DDT

10.088

10.082

6.5

Test substance

5.010

5.006

5.008

5.3

1.8 x 105

 

Applicant's summary and conclusion

Conclusions:
In a GLP-compliant study in accordance with EC A.8, OECD 117 and EPA OPPTS 830.7570 using the HPLC method, the log Pow of the substance has been determined as 5.3.