Registration Dossier
Registration Dossier
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EC number: 610-465-7 | CAS number: 49621-56-9
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Reliability:
- 1 (reliable without restriction)
- Rationale for reliability incl. deficiencies:
- guideline study
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 016
- Report date:
- 2016
Materials and methods
Test guideline
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 117 (Partition Coefficient (n-octanol / water), HPLC Method)
- Version / remarks:
- The determination was carried out using an HPLC Method designed to be compatible with Method A.8 Partition Coefficient of Commission Regulation (EC) No 440/2008 of 30 May 2008 and Method 117 of the OECD Guidelines for Testing of Chemicals, 13 April 2004.
- Deviations:
- no
- GLP compliance:
- yes (incl. QA statement)
- Type of method:
- HPLC method
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- 3-(3,4-Dimethoxyphenyl)propanenitrile
- EC Number:
- 610-465-7
- Cas Number:
- 49621-56-9
- Molecular formula:
- C11H13NO2
- IUPAC Name:
- 3-(3,4-Dimethoxyphenyl)propanenitrile
- Test material form:
- solid: particulate/powder
Constituent 1
Results and discussion
Partition coefficient
- Key result
- Type:
- log Pow
- Partition coefficient:
- ca. 0.685
- Temp.:
- 30 °C
- pH:
- ca. 6.6
Applicant's summary and conclusion
- Conclusions:
- The partition coefficient (n-octanol/water) of the test item has been determined to be 4.84, log10 Pow 0.685.
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