Registration Dossier
Registration Dossier
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EC number: 609-051-9 | CAS number: 35000-37-4
Adsorption / desorption
Administrative data
- Endpoint:
- adsorption / desorption
- Remarks:
- adsorption/desorption
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: EPIWIN Software package 4.10 used. KOCWIN Program (v2.00) for calculation used as a part of EPIWIN software package.
- Justification for type of information:
- QSAR prediction: migrated from IUCLID 5.6
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 014
- Report date:
- 2014
Materials and methods
Test guideline
- Qualifier:
- no guideline followed
- Guideline:
- other: QSAR method
- Deviations:
- yes
- Principles of method if other than guideline:
- QSAR method
- GLP compliance:
- no
- Type of method:
- other: QSAR
Test material
- Reference substance name:
- [2-(tert-butoxy)-2-oxoethyl]triphenylphosphanium chloride
- EC Number:
- 609-051-9
- Cas Number:
- 35000-37-4
- Molecular formula:
- C24H26ClO2P
- IUPAC Name:
- [2-(tert-butoxy)-2-oxoethyl]triphenylphosphanium chloride
- Test material form:
- solid: particulate/powder
- Remarks:
- migrated information: powder
Constituent 1
Study design
Batch equilibrium or other method
- Computational methods:
- EPIWIN Software package 4.10 used. KOCWIN Program (v2.00) for calculation used as a part of EPIWIN software package.
Results and discussion
Adsorption coefficientopen allclose all
- Type:
- log Koc
- Value:
- 0.987
- Temp.:
- 23 °C
- Remarks on result:
- other: KOCWIN v2.00 Results
- Type:
- Koc
- Value:
- 9.699
- Temp.:
- 23 °C
- Remarks on result:
- other: KOCWIN v2.00 Results
Applicant's summary and conclusion
- Validity criteria fulfilled:
- not applicable
- Conclusions:
- Koc Estimate from Log Kow. Corrected Log Koc: 0.9867
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