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Diss Factsheets

Physical & Chemical properties

Partition coefficient

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Administrative data

Endpoint:
partition coefficient
Type of information:
experimental study
Adequacy of study:
key study
Reliability:
1 (reliable without restriction)

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2016

Materials and methods

Test guideline
Qualifier:
equivalent or similar to guideline
Guideline:
other: Commission Regulation (EU) No 283/2013, SECTION 2. Physical and chemical properties of the active substance, 2.7. Partition coefficient n-octanol/water
Principles of method if other than guideline:
Partition coefficient octanol/water was determined by a modified OECD methodology 123 using slow- stirring the mixture. In contrast to this method, the initial EDN concentration was not achieved by dissolution, but by saturation in equipment used for determination of EDN solubility in organic solvents. The resulting value of the partition coefficient is reported as:
πΆπ‘›βˆ’π‘œcπ‘‘π‘Žπ‘›π‘œπ‘™
π‘ƒπ‘‚π‘Š = ------------------- , resp. log POW
𝐢water
GLP compliance:
no
Type of method:
slow-stirring method
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
Oxalonitrile
EC Number:
207-306-5
EC Name:
Oxalonitrile
Cas Number:
460-19-5
Molecular formula:
C2N2
IUPAC Name:
carbononitridic cyanide
Test material form:
gas

Results and discussion

Partition coefficient
Key result
Type:
log Pow
Partition coefficient:
0.08
Temp.:
20 °C
pH:
6.8

Applicant's summary and conclusion

Conclusions:
Partition coefficient n-octanol/water for ethanedinitrile is 0.08.
Executive summary:

Partition coefficient n-octanol/water for ethanedinitrile is 0.08.