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Administrative data

Endpoint:
partition coefficient
Type of information:
experimental study
Adequacy of study:
key study
Study period:
2011-09-22 to 2011-09-23
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
guideline study

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2011
Report date:
2011

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
OECD Guideline 107 (Partition Coefficient (n-octanol / water), Shake Flask Method)
GLP compliance:
yes (incl. QA statement)
Type of method:
flask method
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
ethyl 3-[(pyridin-2-yl)amino]propanoate
EC Number:
600-382-4
Cas Number:
103041-38-9
Molecular formula:
C10 H14 N2 O2
IUPAC Name:
ethyl 3-[(pyridin-2-yl)amino]propanoate

Study design

Analytical method:
gas chromatography

Results and discussion

Partition coefficient
Type:
log Pow
Partition coefficient:
1.54
Temp.:
22 °C
pH:
6

Applicant's summary and conclusion

Conclusions:
From the experimental data obtained according to the guideline A.8 in Official Journal L 383 part A and OECD Test No 107, it can be concluded that the BIBR 1048 Ester sample shows much greater affinity for n-octanol than for water at room temperature (ca. 22 °C) and pH value of the aqueous phases neutral (6.0).
Mean Tot Pow = 34.72
Mean Tot log Pow = 1.54