Registration Dossier
Registration Dossier
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EC number: 825-439-2 | CAS number: 1265906-36-2
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- calculation (if not (Q)SAR)
- Adequacy of study:
- weight of evidence
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- accepted calculation method
Data source
Reference
- Reference Type:
- other: unpublished calculation
- Title:
- Unnamed
- Year:
- 2 017
Materials and methods
Test guideline
- Qualifier:
- no guideline followed
- Principles of method if other than guideline:
- The n-octanol/water partition coefficient was calculated via EPIWIN v4.11, KOWWIN v1.68.
- GLP compliance:
- no
- Type of method:
- other: Data estimated by calculation
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- 1,3-Benzenediol, 2,4,6-trinitro-, calcium potassium salt
- Cas Number:
- 1265906-36-2
- IUPAC Name:
- 1,3-Benzenediol, 2,4,6-trinitro-, calcium potassium salt
- Test material form:
- solid
Constituent 1
Results and discussion
Partition coefficient
- Type:
- log Pow
- Partition coefficient:
- 1.53
- Remarks on result:
- other: data estimated by calculation
Applicant's summary and conclusion
- Conclusions:
- The log Pow was calculated to be 1.53 at 25°C.
- Executive summary:
The n-octanol/water partition coefficient of the test item was calculated via KOWWIN v1.68. According to the calculation, the log Pow is estimated to be 1.53.
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