Registration Dossier

Diss Factsheets

Administrative data

Endpoint:
partition coefficient
Type of information:
experimental study
Adequacy of study:
key study
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
guideline study

Data source

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

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
OECD Guideline 117 (Partition Coefficient (n-octanol / water), HPLC Method)
Version / remarks:
The determination was carried out using an HPLC Method designed to be compatible with Method A.8 Partition Coefficient of Commission Regulation (EC) No 440/2008 of 30 May 2008 and Method 117 of the OECD Guidelines for Testing of Chemicals, 13 April 2004.
Deviations:
no
GLP compliance:
yes (incl. QA statement)
Type of method:
HPLC method
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
(7-Methoxy-3,4-dihydronaphthalen-1-yl)acetonitrile
EC Number:
617-813-7
Cas Number:
861960-34-1
Molecular formula:
C13H13NO
IUPAC Name:
(7-Methoxy-3,4-dihydronaphthalen-1-yl)acetonitrile

Results and discussion

Partition coefficient
Key result
Type:
log Pow
Partition coefficient:
ca. 2.42
Temp.:
30 °C
pH:
ca. 6.6

Applicant's summary and conclusion

Conclusions:
The partition coefficient (n-octanol/water) of the test item has been determined to be 263, log10 Pow 2.42.