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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.