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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

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

Physical & Chemical properties

Partition coefficient

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Administrative data

Endpoint:
partition coefficient
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2000
Report date:
2000

Materials and methods

Test guideline
Qualifier:
equivalent or similar to guideline
Guideline:
other: QSAR-method used
Deviations:
no
Principles of method if other than guideline:
calcualtion by using KOWWIN (LOGKOW) program, version 1.65 by using EPIWIN software package (published and provided by US EPA and in cooperation with Syracuse Research Corp., New York, USA)
GLP compliance:
no
Type of method:
other: QSAR - method used
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
1-chlorododecane
EC Number:
203-981-5
EC Name:
1-chlorododecane
Cas Number:
112-52-7
Molecular formula:
C12H25Cl
IUPAC Name:
1-chlorododecane
Test material form:
liquid
Details on test material:
substance name: 1-chlorododecane
Specific details on test material used for the study:
calcualtion by using KOWWIN (LOGKOW) program, version 1.65 by using EPIWIN software package (published and provided by US EPA and in cooperation with Syracuse Research Corp., New York, USA)

Study design

Analytical method:
other: QSAT method used

Results and discussion

Partition coefficient
Key result
Type:
log Pow
Partition coefficient:
ca. 6.49
Temp.:
25 °C
Remarks on result:
other: QSAR method used
Details on results:
calcualtion by using KOWWIN (LOGKOW) program, version 1.65 by using EPIWIN software package (published and provided by US EPA and in cooperation with Syracuse Research Corp., New York, USA)

Applicant's summary and conclusion

Conclusions:
the calculated result shows a log pow of 6.49