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EC number: 255-424-0 | CAS number: 41519-23-7
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Study period:
- November 16, 2016 to December 22, 2016
- 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 guidelineopen allclose all
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 117 (Partition Coefficient (n-octanol / water), HPLC Method)
- Qualifier:
- according to guideline
- Guideline:
- EU Method A.8 (Partition Coefficient - HPLC Method)
- Qualifier:
- according to guideline
- Guideline:
- EPA OPPTS 830.7570 (Partition Coefficient, n-octanol / H2O, Estimation by Liquid Chromatography)
- GLP compliance:
- yes (incl. QA statement)
- Type of method:
- HPLC method
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- (Z)-hex-3-enyl isobutyrate
- EC Number:
- 255-424-0
- EC Name:
- (Z)-hex-3-enyl isobutyrate
- Cas Number:
- 41519-23-7
- Molecular formula:
- C10H18O2
- IUPAC Name:
- (Z)-hex-3-enyl isobutyrate
Constituent 1
- Specific details on test material used for the study:
- TEST MATERIAL
Name ( stated on the report) : Hexenyl-3-cis Isobutyrate
Appearance: Colourless to pale yellow liquid
Batch: VE00450298
Expiry date: July 15, 2017
Study design
- Analytical method:
- high-performance liquid chromatography
Results and discussion
Partition coefficient
- Key result
- Type:
- log Pow
- Partition coefficient:
- 3.4
- Temp.:
- 35 °C
- pH:
- 7
Applicant's summary and conclusion
- Conclusions:
- In the conditions of the test, the chromatograms of Hexenyl-3-cis Isobutyrate show one peak at average retention times of 5.664 minutes, corresponding to a partition coefficient (log value) of 3.4.
Therefore: Partition coefficient n-octanol/water of Hexenyl-3-cis Isobutyrate: log Pow= 3.4 - Executive summary:
The Partition Coefficient n-octanol/water of Hexenyl-3-cis Isobutyrate was determined by the Reverse Phase High Performance Liquid Chromatographic Method according to the OECD
Guidelines for Testing of Chemicals, Method No. 117.
The result is: Partition coefficient n-octanol/water of Hexenyl-3-cis Isobutyrate: log Pow= 3.4
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