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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
genetic toxicity in vitro
Type of information:
(Q)SAR
Adequacy of study:
supporting study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: The study has been judged as reliable with restrictions since it was conducted by a QSAR model.
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
other: QSAR
Title:
In-vivo mutagenicity (Micronucleus) alerts by ISS
Author:
QSAR Toolbox 3.3.5.17
Year:
2016
Bibliographic source:
QSAR Toolbox 3.3.5.17
Report date:
2016

Materials and methods

Principles of method if other than guideline:
QSAR Toolbox was used to determine the mechanistic profile of the substance.

Test material

Constituent 1
Chemical structure
Reference substance name:
Salt of 4-azidobutan-1-amine and (7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)methanesulfonic acid
EC Number:
943-084-2
Molecular formula:
C14H26N4O4S
IUPAC Name:
Salt of 4-azidobutan-1-amine and (7,7-dimethyl-2-oxobicyclo[2.2.1]hept-1-yl)methanesulfonic acid
Constituent 2
Reference substance name:
NCCCCN=[N+]=[N-].CC1(C)C2CCC1(CS(O)(=O)=O)C(=O)C2
IUPAC Name:
NCCCCN=[N+]=[N-].CC1(C)C2CCC1(CS(O)(=O)=O)C(=O)C2

Results and discussion

Test results
Genotoxicity:
other: inconclusive

Applicant's summary and conclusion

Conclusions:
Interpretation of results (migrated information):
other: inconclusive

QSAR Toolbox identifies a structural alert of concern; in particular for in vivo mutagenicity (Micronucleus) alerts by ISS this altert is "Azide and triazine groups".