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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Currently viewing:

Administrative data

Endpoint:
partition coefficient
Type of information:
(Q)SAR
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: calculated results using KOWWIN (LOGKOW) program, version 1.65, Syracuse Research Corp., Merill Lane, Syracuse, New York 13210, U.S.A., 2000
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

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:
Deviations:
yes
Remarks:
QSAR-method used
Principles of method if other than guideline:
Results are calculated with KOWWlN (LOGKOW~ Program, Version 1.65, Syracuse Research Corporation, Merrill Lane, Syracuse, New YOrk, 13210,
U. S. A., 2000.
GLP compliance:
no
Type of method:
other: QSAR-method
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
1-chlorodecane; 1-chlorododecane
EC Number:
907-241-9
Molecular formula:
C10H21Cl and C12H25Cl
IUPAC Name:
1-chlorodecane; 1-chlorododecane
Details on test material:
- Name of test material as cited in study report: Reaction mass of 1-chlorodecane and 1-chlorododecane

Results and discussion

Partition coefficientopen allclose all
Type:
log Pow
Partition coefficient:
5.51
Remarks on result:
other: 1-chlorodecane
Type:
log Pow
Partition coefficient:
6.48
Remarks on result:
other: 1-chlorododecane
Details on results:
Results are calculated with KOWWlN (LOGKOW~ Program, Version 1.65, Syracuse Research Corporation, Merrill Lane, Syracuse, New YOrk, 13210,
U. S. A., 2000.

Any other information on results incl. tables

Results are calculated with KOWWlN (LOGKOW~ Program, Version 1.65, Syracuse Research Corporation, Merrill Lane, Syracuse, New YOrk, 13210,

U. S. A., 2000.

Applicant's summary and conclusion

Conclusions:
Calculated result of partition coefficient shows log Pow 5.51 for 1-chlorodecane and 6.48 for 1-chlorododecane
Executive summary:

QSAR - Results are calculated with KOWWlN (LOGKOW- Program, Version 1.65, Syracuse Research Corporation, Merrill Lane, Syracuse, New YOrk, 13210, U. S. A., 2000.)