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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Toxicological information

Skin sensitisation

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Administrative data

Endpoint:
skin sensitisation
Remarks:
other: QSAR
Type of information:
(Q)SAR
Adequacy of study:
supporting study
Reliability:
3 (not reliable)
Rationale for reliability incl. deficiencies:
other: DEREK is predominantly designed to predict the presence rather than the absence of structural alerts and its associated toxic properties.
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
other: QSAR Prdiction
Title:
Unnamed
Year:
2014
Report date:
2014

Materials and methods

Principles of method if other than guideline:
DEREK prediction of skin sensitisation potential based on expert rules
GLP compliance:
no
Type of study:
other: QSAR

Test material

Constituent 1
Chemical structure
Reference substance name:
1,1'-ethane-1,2-diylbis(4-nitrobenzene)
EC Number:
212-001-5
Cas Number:
736-30-1
Molecular formula:
C14H12N2O4
IUPAC Name:
1,1'-ethane-1,2-diylbis(4-nitrobenzene)

Results and discussion

Applicant's summary and conclusion

Interpretation of results:
not sensitising
Remarks:
Migrated information Criteria used for interpretation of results: expert judgment
Conclusions:
According to the DEREK prediction the structure suggests no skin sensitizing properties.