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EC number: 263-502-0 | CAS number: 62314-22-1
Partition coefficient
Administrative data
Link to relevant study record(s)
- Endpoint:
- partition coefficient
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Study period:
- July 2017
- Reliability:
- 1 (reliable without restriction)
- Rationale for reliability incl. deficiencies:
- guideline study
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 107 (Partition Coefficient (n-octanol / water), Shake Flask Method)
- Deviations:
- no
- Qualifier:
- according to guideline
- Guideline:
- EU Method A.8 (Partition Coefficient - Shake Flask Method)
- Deviations:
- no
- GLP compliance:
- yes (incl. QA statement)
- Type of method:
- flask method
- Partition coefficient type:
- octanol-water
- Specific details on test material used for the study:
- Identification: Hydroxypropyl, N-2-, N,N,N-trimethylammonium 2-ethylhexanoate
Other name: solvent-free Dabco TMR
Physical state/appearance: yellow viscous liquid
Batch number: meyers1.20160601
CAS Number: 62314-22-1
EU Number: 263-502-0
Purity: 96.5% active in water
Expiry date: 01 June 2017
Storage conditions: Room temperature in the dark - Analytical method:
- high-performance liquid chromatography
- Key result
- Type:
- log Pow
- Partition coefficient:
- 1.2
- Temp.:
- 22 °C
- pH:
- 5
- Conclusions:
- The partition coefficient of the test item has been determined at a nominal pH value of 5 (actual value 4.9) and a test temperature of 22.0 ± 0.5 °C.
Quaternary Amine Cation: Partition coefficient (Pow) <1.01 x 10-2
Log Pow <-2.00
2-Ethylhexanoic Acid Content: Partition coefficient (Pow) 15.9
Log Pow 1.20 - Executive summary:
The partition coefficient (n-octanol/water) of Hydroxypropyl, N-2-, N,N,Ntrimethylammonium 2-ethylhexanoate has been determined at a nominal pH value of 5(actual value 4.9) and a test temperature of 22.0 ± 0.5 °C. Testing used a shake-flask method designed to be compatible with Method A.8 Partition Coefficient of Commission Regulation(EC) No 440/2008 of 30 May 2008 and Method 107 of the OECD Guidelines for Testing ofChemicals, 27 July 1995.
The partition coefficient of the test item has been determined at a nominal pH value of 5 (actual value 4.9) and a test temperature of 22.0 ± 0.5 °C.
Quaternary Amine Cation: Partition coefficient (Pow) <1.01 x 10-2
Log Pow <-2.00
2-Ethylhexanoic Acid Content: Partition coefficient (Pow) 15.9
Log Pow 1.20
Reference
Description of key information
The partition coefficient of the test item has been determined at a nominal pH value of 5 (actual value 4.9) and a test temperature of 22.0 ± 0.5 °C.
Quaternary Amine Cation: Partition coefficient (Pow) <1.01 x 10 -2
Log Pow <-2.00
2-Ethylhexanoic Acid Content: Partition coefficient (Pow) 15.9
Log Pow 1.20
Key value for chemical safety assessment
- Log Kow (Log Pow):
- 1.2
- at the temperature of:
- 22 °C
Additional information
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