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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
partition coefficient
Type of information:
calculation (if not (Q)SAR)
Remarks:
Migrated phrase: estimated by calculation
Adequacy of study:
key study
Reliability:
1 (reliable without restriction)

Data source

Reference
Reference Type:
publication
Title:
No information
Year:
2010
Bibliographic source:
The result is by Chemspider database.

Materials and methods

Test guideline
Qualifier:
no guideline followed
Principles of method if other than guideline:
EPISuite
GLP compliance:
no
Type of method:
other: calculation method
Partition coefficient type:
octanol-water

Test material

Constituent 1
Chemical structure
Reference substance name:
2,4-dichloro-1,3-dinitro-5-(trifluoromethyl)benzene
EC Number:
249-420-8
EC Name:
2,4-dichloro-1,3-dinitro-5-(trifluoromethyl)benzene
Cas Number:
29091-09-6
Molecular formula:
C7HCl2F3N2O4
IUPAC Name:
2,4-dichloro-1,3-dinitro-5-(trifluoromethyl)benzene

Results and discussion

Partition coefficient
Type:
log Pow
Partition coefficient:
3.88
Remarks on result:
other: Temperature and pH values are not available.

Applicant's summary and conclusion

Conclusions:
The partition coefficient calculation by Chemspider database using EPISuite was: 3.88