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The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

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
Study period:
Study initiation date: 29 July 2009 Study completion date: 27. January 2010
Reliability:
1 (reliable without restriction)

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2010
Report date:
2009

Materials and methods

Test guidelineopen allclose all
Qualifier:
according to guideline
Guideline:
OECD Guideline 117 (Partition Coefficient (n-octanol / water), HPLC Method)
Qualifier:
according to guideline
Guideline:
EU Method A.8 (Partition Coefficient)
GLP compliance:
yes
Type of method:
HPLC method
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
Isovaleraldehyde
EC Number:
209-691-5
EC Name:
Isovaleraldehyde
Cas Number:
590-86-3
Molecular formula:
C5H10O
IUPAC Name:
3-methylbutanal

Results and discussion

Partition coefficientopen allclose all
Type:
Pow
Partition coefficient:
31.5
Temp.:
25 °C
pH:
7
Type:
log Pow
Partition coefficient:
1.5
Temp.:
25 °C
pH:
7

Applicant's summary and conclusion

Conclusions:
Partition coefficient n-octanol / water (Pow): Pow = 31.5 / log Pow = 1.5
Executive summary:

The partition coefficient n-octanol / water (Pow) of the test item was determined according to OECD guideline no. 117 [adopted on 13 April 2004] and EU test method A.8 [Directive 92/69/EEC, Official Journal L 383 A 1992] with the HPLC method.

Partition coefficient n-octanol / water (Pow): Pow = 31.5 / log Pow = 1.5