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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

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:
migrated information: read-across from supporting substance (structural analogue or surrogate)
Adequacy of study:
weight of evidence
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Scientically acceptable method

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
1988
Report date:
1988

Materials and methods

Test guideline
Qualifier:
equivalent or similar to guideline
Guideline:
OECD Guideline 107 (Partition Coefficient (n-octanol / water), Shake Flask Method)
GLP compliance:
no
Type of method:
shake-flask method to: flask method
Remarks:
similar to OEDCD guideline 107
Partition coefficient type:
octanol-water

Test material

Constituent 1
Reference substance name:
Citral
EC Number:
226-394-6
EC Name:
Citral
Cas Number:
5392-40-5
IUPAC Name:
3,7-dimethylocta-2,6-dienal
Details on test material:
- Name of test material (as cited in study report): citral
- Analytical purity: 93.6%
, (cis-, trans- isomere)

Results and discussion

Partition coefficient
Type:
log Pow
Partition coefficient:
2.76
Temp.:
25 °C

Any other information on results incl. tables

No data available for pH value.
The substance has no ionic structure, therefore the pH value is not relevant.

Summary of results
---------------------------
/ P(OW) / log P(OW)
1. Weighed sample / 571 / 2.76
2. Weighed sample / 571 / 2.76
3. Weighed sample / 567 / 2.75

Mean / 570 / 2.76

Standard deviation +/- 2

The partition coefficient of Citral in 1-Octanol/Water at 25°C, log Pow = 2.76.

Applicant's summary and conclusion