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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Environmental fate & pathways

Adsorption / desorption

Currently viewing:

Administrative data

Endpoint:
adsorption / desorption
Remarks:
adsorption
Type of information:
(Q)SAR
Adequacy of study:
weight of evidence
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Regulatory accepted model for assessment of chemical substances
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
other company data
Title:
Unnamed
Year:
2009

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
other: QSAR modeling
Principles of method if other than guideline:
Study type: QSARs model KOCWIN v.2.00 (estimate from MCI and from log Kow )
GLP compliance:
no
Remarks:
not applicable to QSAR models
Type of method:
other: QSAR modeling
Media:
soil

Test material

Constituent 1
Chemical structure
Reference substance name:
Butylbenzene
EC Number:
203-209-7
EC Name:
Butylbenzene
Cas Number:
104-51-8
Molecular formula:
C10H14
IUPAC Name:
butylbenzene
Details on test material:
Component substance

Results and discussion

Any other information on results incl. tables

Study type: QSARs model

KOCWIN v.2.00

 

estimate from MCI and

from log Kow

KOCWIN v.2.00

Adsorption coefficient:

 

Koc: 1482 L/kg (Estimate from MCI)

log Koc: 3.1708

(Estimate from MCI)

 

Koc: 6324 L/kg (Estimate from log Kow)

log Koc: 3.8010

(Estimate from log Kow)

2 (reliable with

restrictions)

 

key study

 

(Q)SAR

EPI Suite

v.4.00

Applicant's summary and conclusion

Conclusions:
QSAR estimated (component data):
Adsorption coefficient:

Koc: 1482 L/kg (Estimate from MCI); log Koc: 3.1708 (Estimate from MCI);
Koc: 6324 L/kg (Estimate from log Kow); log Koc: 3.8010 (Estimate from log Kow).