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Registration Dossier
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EC number: 282-773-6 | CAS number: 84418-61-1
Partition coefficient
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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:
- 2 018
Materials and methods
- Principles of method if other than guideline:
- QSAR
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
- Test material form:
- liquid
- Details on test material:
- - State of aggregation: not applicable
- Activation: not required
water as a additive
Constituent 1
additive 1
- Specific details on test material used for the study:
- SOURCE OF TEST MATERIAL
not applicable because several individual structures calculated
Study design
- Analytical method:
- other:
Results and discussion
Partition coefficient
- Key result
- Type:
- log Pow
- Partition coefficient:
- >= -1.71 - <= 0.08
- Temp.:
- 25 °C
- Remarks on result:
- other: QSAR
- Remarks:
- calculated for proofed and postulated constituents, imidazole only for comparison
Applicant's summary and conclusion
- Conclusions:
- Kow calculated by EPIWIN program was -0.93 to 1.58 for all constituents
Not ready - Executive summary:
Kow calculated by EPIWIN program (KOWWIN v1.67 or v1.68) of the US EPA (Environmental protection Agency) QSAR was -0.93 to 1.58 for all constituents
Not ready
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