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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
(Q)SAR
Adequacy of study:
other information
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method

Data source

Materials and methods

Principles of method if other than guideline:
KOWWIN v1.67 estimate
GLP compliance:
no
Type of method:
calculation method (fragments)
Remarks:
KOWWIN v1.67 estimate

Test material

Constituent 1
Chemical structure
Reference substance name:
3-chloro-α,α,α-trifluorotoluene
EC Number:
202-642-9
EC Name:
3-chloro-α,α,α-trifluorotoluene
Cas Number:
98-15-7
Molecular formula:
C7H4ClF3
IUPAC Name:
1-chloro-3-(trifluoromethyl)benzene
Test material form:
liquid

Results and discussion

Partition coefficient
Key result
Type:
log Pow
Partition coefficient:
3.6
Temp.:
25 °C
Remarks on result:
other: QSAR

Applicant's summary and conclusion

Conclusions:
The Log Kow of 3-Chlorobenzotrifluoride has been calculated to be 3.60 at 25°C.