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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
skin irritation / corrosion, other
Remarks:
In silico
Type of information:
(Q)SAR
Adequacy of study:
weight of evidence
Reliability:
4 (not assignable)
Rationale for reliability incl. deficiencies:
results derived from a (Q)SAR model, with limited documentation / justification
Justification for type of information:
QSAR prediction

Data source

Reference
Reference Type:
other: Predicted data
Title:
Unnamed
Year:
2015

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
other: REACH guidance on QSARs R.6, May/July2008
GLP compliance:
not specified

Test material

Constituent 1
Chemical structure
Reference substance name:
1-benzyl-4-(4-fluorophenyl)-1,2,3,6-tetrahydropyridine, salt with p-toluenesulfonic acid
EC Number:
606-457-8
Cas Number:
201855-54-1
Molecular formula:
C18H17FN*C7H8O3S
IUPAC Name:
1-benzyl-4-(4-fluorophenyl)-1,2,3,6-tetrahydropyridine, salt with p-toluenesulfonic acid
Test material form:
solid: crystalline

Results and discussion

In vivo

Results
Irritation parameter:
other: Primal Irritation Index
Score:
3.67
Remarks on result:
other: Database: Skin irritation

Applicant's summary and conclusion

Interpretation of results:
Category 2 (irritant) based on GHS criteria
Conclusions:
According to (Q)SAR modell: QSAR Toolbox, the predicted value indicated that tetrahydro-pyridine-tosilate is irritating to skin. The result meets the requirement of Hazard Category 2.