Registration Dossier
Registration Dossier
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EC number: 839-928-3 | CAS number: 174072-89-0
Oxidising properties
Administrative data
- Endpoint:
- oxidising solids
- 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:
- (Q)SAR prediction
Data source
Reference
- Reference Type:
- other: QSAR prediction
- Title:
- QSAR prediction of oxidising properties of NTC
- Author:
- Gedeon Richter Plc.
- Year:
- 2 022
- Bibliographic source:
- QSAR Toolbox 4.5 SP1
- Report date:
- 2022
Materials and methods
Test guideline
- Qualifier:
- according to guideline
- Guideline:
- other: Guidance o QSARs R.6 May/July 2008
- GLP compliance:
- not specified
Test material
- Reference substance name:
- Ethyl 2-amino-4-methyl-5-(4-nitrophenyl)thiophene-3-carboxylate
- EC Number:
- 839-928-3
- Cas Number:
- 174072-89-0
- Molecular formula:
- C14H14N2O4S
- IUPAC Name:
- Ethyl 2-amino-4-methyl-5-(4-nitrophenyl)thiophene-3-carboxylate
- Test material form:
- solid: crystalline
Constituent 1
Results and discussion
Test results (Oxidising solids)
- Sample tested:
- other: QSAR prediction
- Parameter:
- other: GHS criteria not met
- Remarks on result:
- other: no indication of oxidising poperties based on the similar molecules to NTC found by QSAR Toolbox 4.5
Applicant's summary and conclusion
- Interpretation of results:
- GHS criteria not met
- Conclusions:
- According to the grouping conducted using (Q)SAR Toolbox 4.5, the similar molecules to NTC that the software has found have no oxidising properties. Therefore it is assumed that NTC neither has oxidising properties.
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