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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Currently viewing:

Administrative data

Endpoint:
skin sensitisation, other
Type of information:
(Q)SAR
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
results derived from a valid (Q)SAR model and falling into its applicability domain, with adequate and reliable documentation / justification
Justification for type of information:
See QMRF document in cross-reference.
Cross-reference
Reason / purpose for cross-reference:
(Q)SAR model reporting (QMRF)

Data source

Referenceopen allclose all

Reference Type:
publication
Title:
Unnamed
Year:
2005
Report date:
2005
Reference Type:
study report
Title:
Unnamed
Year:
2007
Report date:
2007

Materials and methods

Test guideline
Qualifier:
no guideline followed
Principles of method if other than guideline:
The QSAR Toolbox version 4.3.1 was used to assess skin sensitisation potential

Test material

Constituent 1
Chemical structure
Reference substance name:
Isoprene
EC Number:
201-143-3
EC Name:
Isoprene
Cas Number:
78-79-5
Molecular formula:
C5H8
IUPAC Name:
2-methylbuta-1,3-diene

Results and discussion

In vitro / in chemico

Results
Remarks on result:
no indication of skin sensitisation

Any other information on results incl. tables

Protein binding alerts for skin sensitization according to GHS - No alerts found

Protein binding alerts for skin sensitization by OASIS - No alerts found

Applicant's summary and conclusion

Interpretation of results:
GHS criteria not met
Conclusions:
Protein binding alerts for skin sensitization according to GHS - No alerts found
Protein binding alerts for skin sensitization by OASIS - No alerts found

These (Q)SAR results indicate that isoprene should be "not classified" for skin sensitisation
Executive summary:

Protein binding alerts for skin sensitization according to GHS - No alerts found

Protein binding alerts for skin sensitization by OASIS - No alerts found

These (Q)SAR results indicate that isoprene should be "not classified" for skin sensitisation