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Diss Factsheets
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EC number: 292-054-9 | CAS number: 90530-16-8
- Life Cycle description
- Uses advised against
- Endpoint summary
- Appearance / physical state / colour
- Melting point / freezing point
- Boiling point
- Density
- Particle size distribution (Granulometry)
- Vapour pressure
- Partition coefficient
- Water solubility
- Solubility in organic solvents / fat solubility
- Surface tension
- Flash point
- Auto flammability
- Flammability
- Explosiveness
- Oxidising properties
- Oxidation reduction potential
- Stability in organic solvents and identity of relevant degradation products
- Storage stability and reactivity towards container material
- Stability: thermal, sunlight, metals
- pH
- Dissociation constant
- Viscosity
- Additional physico-chemical information
- Additional physico-chemical properties of nanomaterials
- Nanomaterial agglomeration / aggregation
- Nanomaterial crystalline phase
- Nanomaterial crystallite and grain size
- Nanomaterial aspect ratio / shape
- Nanomaterial specific surface area
- Nanomaterial Zeta potential
- Nanomaterial surface chemistry
- Nanomaterial dustiness
- Nanomaterial porosity
- Nanomaterial pour density
- Nanomaterial photocatalytic activity
- Nanomaterial radical formation potential
- Nanomaterial catalytic activity
- Endpoint summary
- Stability
- Biodegradation
- Bioaccumulation
- Transport and distribution
- Environmental data
- Additional information on environmental fate and behaviour
- Ecotoxicological Summary
- Aquatic toxicity
- Endpoint summary
- Short-term toxicity to fish
- Long-term toxicity to fish
- Short-term toxicity to aquatic invertebrates
- Long-term toxicity to aquatic invertebrates
- Toxicity to aquatic algae and cyanobacteria
- Toxicity to aquatic plants other than algae
- Toxicity to microorganisms
- Endocrine disrupter testing in aquatic vertebrates – in vivo
- Toxicity to other aquatic organisms
- Sediment toxicity
- Terrestrial toxicity
- Biological effects monitoring
- Biotransformation and kinetics
- Additional ecotoxological information
- Toxicological Summary
- Toxicokinetics, metabolism and distribution
- Acute Toxicity
- Irritation / corrosion
- Sensitisation
- Repeated dose toxicity
- Genetic toxicity
- Carcinogenicity
- Toxicity to reproduction
- Specific investigations
- Exposure related observations in humans
- Toxic effects on livestock and pets
- Additional toxicological data
Endpoint summary
Administrative data
Key value for chemical safety assessment
Genetic toxicity in vitro
Link to relevant study records
- Endpoint:
- in vitro gene mutation study in bacteria
- Remarks:
- Type of genotoxicity: gene mutation
- 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:
- QSAR prediction: migrated from IUCLID 5.6
- Principles of method if other than guideline:
- TIMES AMES model predictions and Toolbox read-across analyses
- GLP compliance:
- no
- Type of assay:
- bacterial reverse mutation assay
- Species / strain:
- not specified
- Metabolic activation:
- not specified
- Genotoxicity:
- negative
- Remarks:
- QSAR prediction
- Cytotoxicity / choice of top concentrations:
- not specified
- Vehicle controls validity:
- not specified
- Untreated negative controls validity:
- not specified
- Positive controls validity:
- not specified
- Remarks on result:
- other: other: QSAR
- Remarks:
- Migrated from field 'Test system'.
- Conclusions:
- Interpretation of results (migrated information):
negative Not classified as mutagen.
Not classified as mutagen. - Executive summary:
Based on the experimental data for structural analogues, TIMES AMES model predictions and Toolbox read-across analyses, theUVCB2-Propenenitrile, reaction products with 1,3-benzenedimethanamineis ultimately predicted as in vitro Ames negative, i.e. not capable of eliciting mutagenicity.
- Endpoint:
- in vitro cytogenicity / chromosome aberration study in mammalian cells
- 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:
- QSAR
- Qualifier:
- no guideline followed
- Version / remarks:
- It is a QSAR report.
- Principles of method if other than guideline:
- QSAR report
- GLP compliance:
- no
- Key result
- Species / strain:
- not specified
- Remarks:
- QSAR
- Metabolic activation:
- not specified
- Genotoxicity:
- negative
- Remarks:
- NOT CLASTOGENIC, being predicted negative for in vitro clastogenicity as chromosome aberration in CHL and CHO cells.
- Cytotoxicity / choice of top concentrations:
- not specified
- Remarks:
- not specified in the QSAR
- Conclusions:
- The computational toxicology assessment based on QSAR methodology predicted 2-Propenenitrile, reaction products with 1,3-benzenedimethanamine as NOT CLASTOGENIC, being predicted negative for in vitro clastogenicity as chromosome aberration in CHL and CHO cells. The prediction was assessed as moderate reliable.
- Executive summary:
The computational toxicology assessment based on QSAR methodology predicted 2-Propenenitrile, reaction products with 1,3-benzenedimethanamine as NOT CLASTOGENIC, being predicted negative for in vitro clastogenicity as chromosome aberration in CHL and CHO cells. The prediction was assessed as moderate reliable.
Referenceopen allclose all
Based on the experimental data for structural analogues, TIMES AMES model predictions and Toolbox read-across analyses, the UVCB 2-Propenenitrile, reaction products with 1,3-benzenedimethanamine is ultimately predicted as in vitro Ames negative, i.e. not capable of eliciting mutagenicity.
Endpoint conclusion
- Endpoint conclusion:
- no adverse effect observed (negative)
Genetic toxicity in vivo
Endpoint conclusion
- Endpoint conclusion:
- no adverse effect observed (negative)
Additional information
· in vitro AMES mutagenicity
Based on the experimental data for structural analogues, TIMES AMES model predictions and Toolbox read-across analyses, theUVCB2-Propenenitrile, reaction products with 1,3-benzenedimethanamineis ultimately predicted as in vitro Ames negative, i.e. not capable of eliciting mutagenicity.
-
The computational toxicology assessment based on QSAR methodology predicted 2-Propenenitrile, reaction products with 1,3-benzenedimethanamine as NOT CLASTOGENIC, being predicted negative for in vitro clastogenicity as chromosome aberration in CHL and CHO cells. The prediction was assessed as moderate reliable.
Justification for classification or non-classification
in vitroAMES mutagenicity
Based on the experimental data for structural analogues, TIMES AMES model predictions and Toolbox read-across analyses, theUVCB2-Propenenitrile, reaction products with 1,3-benzenedimethanamineis ultimately predicted as in vitro Ames negative, i.e. not capable of eliciting mutagenicity.
The computational toxicology assessment based on QSAR methodology predicted 2-Propenenitrile, reaction products with 1,3-benzenedimethanamine as NOT CLASTOGENIC, being predicted negative for in vitro clastogenicity as chromosome aberration in CHL and CHO cells. The prediction was assessed as moderate reliable.
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