Registration Dossier
Registration Dossier
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EC number: 206-323-5 | CAS number: 327-62-8
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- results derived from a valid (Q)SAR model and falling into its applicability domain, with adequate and reliable documentation / justification
Data source
Reference
- Reference Type:
- other company data
- Title:
- Unnamed
- Year:
- 2 021
- Report date:
- 2021
Materials and methods
Test guideline
- Qualifier:
- no guideline followed
- Principles of method if other than guideline:
- - Software tool(s) used including version:Estimation Programs Interface Suite™ for Microsoft® Windows v4.11. US EPA, United States Environmental Protection Agency, Washington, DC, USA.
- Model(s) used: KOWWIN v1.68
- Model description: see field 'Attached justification'
- Justification of QSAR prediction: see field 'Attached justification' - GLP compliance:
- no
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- Potassium propionate
- EC Number:
- 206-323-5
- EC Name:
- Potassium propionate
- Cas Number:
- 327-62-8
- Molecular formula:
- C3H6O2.K
- IUPAC Name:
- potassium propionate
- Test material form:
- solid: particulate/powder
Constituent 1
Results and discussion
Partition coefficient
- Key result
- Type:
- log Pow
- Partition coefficient:
- -3.23
- Temp.:
- 25 °C
- Remarks on result:
- other: pH was not reported/is not applicable for in silico study
Applicant's summary and conclusion
- Conclusions:
- The partition coeffcient of Potassium Propionate was estimated to be -3.23 at 25°C.
- Executive summary:
The Partition coefficient of Potassium Propionate was estimated with Estimation Programs Interface Suite™ for Microsoft® Windows v4.11. US EPA, United States Environmental Protection Agency, Washington, DC, USA, KOWWIN v1.68. At 25°C Potassium Propionate has a logKow of -3.23 according to the prediction.
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