Registration Dossier

Data platform availability banner - registered substances factsheets

Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
skin sensitisation
Remarks:
other: silico prediction
Type of information:
(Q)SAR
Adequacy of study:
key study
Study period:
2010
Reliability:
2 (reliable with restrictions)
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2010
Report date:
2010

Materials and methods

Test guideline
Qualifier:
no guideline followed
Principles of method if other than guideline:
In silico prediction.
DEREK is a knowledge-based expert system designed to apply structure-activity relationships to compounds for which little or no data exists and hence to aid in the assessment of their potential toxicity. The DEREK knowledge base contains a large number of rules that associate a chemical structure with one or more toxicity end points. When a structural alert is identified a reasoning programme assigns a probability to the expression of toxicity by the test compound.
GLP compliance:
not specified
Type of study:
other: silico prediction

Test material

Constituent 1
Chemical structure
Reference substance name:
1-(m-chlorophenyl)piperazine
EC Number:
229-654-7
EC Name:
1-(m-chlorophenyl)piperazine
Cas Number:
6640-24-0
Molecular formula:
C10H13ClN2
IUPAC Name:
1-(3-chlorophenyl)piperazine

Results and discussion

Any other information on results incl. tables

The presence of a skin sensitization structural alert within a molecule indicates the molecule has the potential to cause skin sensitization. Whether or not the molecule will be a skin sensitizer will also depend upon its percutaneous absorption. Generally, small lipophilic molecules are more readily absorbed into the skin and are therefore more likely to cause sensitization.

plausible: the weight of evidence supports the proposition

Applicant's summary and conclusion

Interpretation of results:
other: plausible Alert
Remarks:
Criteria used for interpretation of results: expert judgment
Conclusions:
The presence of a skin sensitization structural alert within a molecule indicates the molecule has the potential to cause skin sensitization. Whether or not the molecule will be a skin sensitizer will also depend upon its percutaneous absorption. Generally, small lipophilic molecules are more readily absorbed into the skin and are therefore more likely to cause sensitization.