Isobutylbenzene

Partition coefficient

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:

2017

Report date:

2017

Materials and methods

Test guideline

Qualifier:

according to guideline

Guideline:

OECD Guideline 117 (Partition Coefficient (n-octanol / water), HPLC Method)

Deviations:

no

GLP compliance:

yes (incl. QA statement)

Type of method:

HPLC method

Partition coefficient type:

octanol-water

Test material

Test material information

Constituent 1

Reference substance name:

Isobutylbenzene

EC Number:

208-706-2

EC Name:

Isobutylbenzene

Cas Number:

538-93-2

Molecular formula:

C10H14

IUPAC Name:

(2-methylpropyl)benzene

Test material form:

liquid

Specific details on test material used for the study:

Purity of the test material: >95 %
Batch number: EXP-18/11/346

Study design

Analytical method:

high-performance liquid chromatography

Results and discussion

Partition coefficient

Key result

Type:

log Pow

Partition coefficient:

4.8

Temp.:

23 °C

pH:

6

Remarks on result:

other: pH value of the water used for the preperation of the eluent.

Any other information on results incl. tables

Individual results:

Component	t (min) mean value out of two determinations	k	log k	log Pow
Formamide	1.5
Ethylenzoate	4.0	1.72	0.234	2.6
Toluene	4.8	2.23	0.349	2.7
Ethylbenzene	6.2	3.15	0.498	3.2
Cumene	7.2	4.23	0.626	3.7
n-Butylbezene	12.2	7.20	0.857	4.6
Bibenzyl	10.3	5.92	0.773	4.8
DDT	23.9	15.12	1.180	6.5
Test Item	11.7	6.85	0.836	4.8