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Physical & Chemical properties

Partition coefficient

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Reference
Endpoint:
partition coefficient
Type of information:
experimental study
Adequacy of study:
key study
Study period:
2016-03-14 to 2016-03-24
Reliability:
2 (reliable with restrictions)
Qualifier:
according to guideline
Guideline:
OECD Guideline 107 (Partition Coefficient (n-octanol / water), Shake Flask Method)
Deviations:
yes
Remarks:
partition coefficient was determined from the individual solubilities in water and 1-octanol
GLP compliance:
yes
Type of method:
other: individual solubilities in water and 1-octanol
Partition coefficient type:
octanol-water
Analytical method:
high-performance liquid chromatography
Type:
log Pow
Partition coefficient:
1.9
Temp.:
20 °C
Remarks on result:
other: calculated from solubilities in water and octanol
Remarks:
pH not specified

1-Octanol solubility of the test item at 20 °C is 71.72 g/L.

The water solubility was determined to be 878.4 mg/L.

Conclusions:
The log Kow of C18 and C18 unsatd. TEA-Esterquat was determined to be 1.9 at 20°C.
Executive summary:

The n-Octanol/water partitioning coefficient (log Kow) of C18 and C18 unsatd. TEA-Esterquat was calculated from the individual solubilities in 1-octanol and water at 20 °C, respectively. The log Kow is reported to be 1.9 at 20°C.

However, due to the surface-active properties of the test substance, the 'real' water solubility is overestimated. Therefore the result should be treated with care.

Description of key information

log Kow = 1.9 (OECD TG 107)

Key value for chemical safety assessment

Log Kow (Log Pow):
1.9
at the temperature of:
20 °C

Additional information

The n-Octanol/water partitioning coefficient (log Kow) of C18 and C18 unsatd. TEA-Esterquat was calculated from the individual solubilities in 1-octanol and water at 20 °C, respectively. The log Kow is reported to be 1.9 at 20°C.


However, due to the surface-active properties of the test substance, the 'real' water solubility is overestimated. Therefore the result should be treated with care.