Registration Dossier
Registration Dossier
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EC number: 469-300-0 | CAS number: 63675-73-0
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Study period:
- Jun 2006 to Feb 2007
- Reliability:
- 1 (reliable without restriction)
- Rationale for reliability incl. deficiencies:
- guideline study
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 007
- Report date:
- 2007
Materials and methods
Test guidelineopen allclose all
- Qualifier:
- according to guideline
- Guideline:
- EU Method A.8 (Partition Coefficient - HPLC Method)
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 117 (Partition Coefficient (n-octanol / water), HPLC Method)
- GLP compliance:
- yes
- Type of method:
- HPLC method
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- -
- EC Number:
- 469-300-0
- EC Name:
- -
- Cas Number:
- 63675-73-0
- Molecular formula:
- Hill Empirical Formula: C16H16O3S CAS Empirical Formula: C16H16O3S
- IUPAC Name:
- 1-(4-methoxyphenyl)-2-[(3-methoxyphenyl)sulfanyl]ethan-1-one
- Test material form:
- solid: particulate/powder
- Details on test material:
- Sponsor batch no: 151105Purity: 99.9%
Constituent 1
Study design
- Analytical method:
- high-performance liquid chromatography
Results and discussion
Partition coefficient
- Type:
- log Pow
- Partition coefficient:
- 3.71
- Temp.:
- 25 °C
- Remarks on result:
- not measured/tested
- Remarks:
- pH not specified
Applicant's summary and conclusion
- Conclusions:
- The octanol:water partition coefficient of Beta Ketosulfide was evaluated using the HPLC simulation technique with a mobile phase of methanol:water 75:25 v/v. The test substance eluted as a single component with a retention time corresponding to a log Pow value of +3.71, which was within a 95% confidence range of +3.47 to +4.06.
- Executive summary:
The octanol:water partition coefficient was estimated by the HPLC simulation method using isocratic elution. The procedure conformed to those outlined in EC directive 92/69/EEC Method A8 and OECD Guideline 117.
A log Pow value of +3.71 was determined using this method.
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