Registration Dossier
Registration Dossier
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EC number: 204-120-6 | CAS number: 115-99-1
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Study period:
- 15 May 2014 - 24 July 2014
- Reliability:
- 1 (reliable without restriction)
- Rationale for reliability incl. deficiencies:
- other: A modern GLP study conducted according the appropriate guidelines.
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 014
- Report date:
- 2014
Materials and methods
Test guidelineopen allclose all
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 117 (Partition Coefficient (n-octanol / water), HPLC Method)
- Deviations:
- no
- Qualifier:
- according to guideline
- Guideline:
- EU Method A.8 (Partition Coefficient)
- Deviations:
- no
- GLP compliance:
- yes (incl. QA statement)
- Type of method:
- HPLC method
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- Linalyl formate
- EC Number:
- 204-120-6
- EC Name:
- Linalyl formate
- Cas Number:
- 115-99-1
- Molecular formula:
- C11H18O2
- IUPAC Name:
- linalyl formate
- Reference substance name:
- Linalyl acetate
- EC Number:
- 204-116-4
- EC Name:
- Linalyl acetate
- Cas Number:
- 115-95-7
- Molecular formula:
- C12H20O2
- IUPAC Name:
- 1,5-dimethyl-1-vinylhex-4-en-1-yl acetate
- Reference substance name:
- Linalool
- EC Number:
- 201-134-4
- EC Name:
- Linalool
- Cas Number:
- 78-70-6
- Molecular formula:
- C10H18O
- IUPAC Name:
- 3,7-dimethylocta-1,6-dien-3-ol
- Test material form:
- liquid
- Details on test material:
- - Name of test material (as cited in study report):Linalyl formate
- Molecular formula: C11H18O2
- Molecular weight: 182.3 g/mol
- Physical state: clear colorless liquid
Constituent 1
impurity 1
impurity 2
Study design
- Analytical method:
- high-performance liquid chromatography
Results and discussion
Partition coefficientopen allclose all
- Type:
- Pow
- Partition coefficient:
- 5 140
- Temp.:
- 30 °C
- pH:
- ca. 6.6
- Key result
- Type:
- log Pow
- Partition coefficient:
- 3.71
- Temp.:
- 30 °C
- pH:
- ca. 6.6
- Details on results:
- Note: Testing was performed at 30°C (column temperature), however the values can be considered to represent the values at an unspecified, probably ambient temperature since no mention is made in the guidelines of the temperature at which the tabulated reference substances log Kow values were determined. Partition coefficients of the test and reference substances are assumed to vary with temperature in the same way
Any other information on results incl. tables
No further data
Applicant's summary and conclusion
- Conclusions:
- The partition coefficient (n-octanol/water) of Linalyl formate was 5.14 x 10^3, log10 Pow 3.71.
- Executive summary:
The partition coefficient (n-octanol/water) of Linalyl formate was measured according to OECD Guideline No. 117 (HLPC method).
The partition coefficient (n-octanol/water) of Linalyl formate was 5.14 x 10^3, log10 Pow 3.71.
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