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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
experimental study
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Guideline-Studie

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
1991
Report date:
1991

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
OECD Guideline 107 (Partition Coefficient (n-octanol / water), Shake Flask Method)
GLP compliance:
no
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
4-tert-butylbenzaldehyde
EC Number:
213-367-9
EC Name:
4-tert-butylbenzaldehyde
Cas Number:
939-97-9
Molecular formula:
C11H14O
IUPAC Name:
4-tert-butylbenzaldehyde
Details on test material:
Name of test material (as cited in study report): 4-tert-butylbenzaldehyde
Analytical purity: 99.4 %

Results and discussion

Partition coefficient
Type:
log Pow
Partition coefficient:
3.1
Temp.:
25 °C

Any other information on results incl. tables

RS-Freetext:
Brutto retention time of the test substance 29.7 min
log k' 1.229
Log POW= 1.181 x 1.229 + 1.641 = 3.1

Applicant's summary and conclusion