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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

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Administrative data

Endpoint:
partition coefficient
Type of information:
(Q)SAR
Adequacy of study:
key study
Study period:
2018
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2018

Materials and methods

Principles of method if other than guideline:
The Kow which were calculated were derived from EPIWIN program (KOWWIN v1.67 or v1.68) of the US EPA (Environmental protection Agency )
1. SOFTWARE
EPIWIN program (KOWWIN v1.67 or v1.68) of the US EPA (Environmental protection Agency )
2. MODEL (incl. version number)
v1.68

GLP compliance:
no
Remarks:
not required because QSAR
Other quality assurance:
other:
Type of method:
calculation method (fragments)
Partition coefficient type:
octanol-water

Test material

Specific details on test material used for the study:
SOURCE OF TEST MATERIAL
- Source and lot/batch No.of test material: QSAR. The test material is representative of the registered substance.
- Expiration date of the lot/batch: not relevant
- Purity test date: not relevant

STABILITY AND STORAGE CONDITIONS OF TEST MATERIAL
not relevant

TREATMENT OF TEST MATERIAL PRIOR TO TESTING
not relevant

Study design

Analytical method:
other:

Results and discussion

Partition coefficient
Key result
Type:
log Pow
Partition coefficient:
>= -2.78 - < 1.23
Temp.:
25 °C
pH:
7
Remarks on result:
other: QSAR
Remarks:
calculated for several predicted const. but result not assumed to be realistic

Applicant's summary and conclusion

Conclusions:
log Kow calculated by EPIWIN program was -2.78 to 1.23 for postualted constituents but these data were not representative for the industrial product which is solubule >100 g/L and it is therefore assumed that major constituents have higher log Kow
Executive summary:

log Kow calculated by EPIWIN program (KOWWIN v1.67 or v1.68) of the US EPA (Environmental protection Agency) QSAR vary over a broad range from -2.78 to 1.23