Registration Dossier

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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Administrative data

Endpoint:
adsorption / desorption
Remarks:
adsorption
Type of information:
(Q)SAR
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Scientific acceptable calculation
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
other: Epiwin calculation
Title:
Unnamed
Year:
2003
Report date:
2003

Materials and methods

Principles of method if other than guideline:
PCKOCWIN v1.66
Type of method:
other: calculation
Media:
soil

Test material

Constituent 1
Chemical structure
Reference substance name:
3-cyano-3,5,5-trimethylcyclohexanone
EC Number:
411-490-4
EC Name:
3-cyano-3,5,5-trimethylcyclohexanone
Cas Number:
7027-11-4
Molecular formula:
C10 H15 N O
IUPAC Name:
3-cyano-3,5,5-trimethylcyclohexanone

Results and discussion

Adsorption coefficientopen allclose all
Type:
Koc
Value:
32.22
Type:
log Koc
Value:
1.51

Applicant's summary and conclusion