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Diss Factsheets
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EC number: 269-084-6 | CAS number: 68187-29-1
- 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
Description of key information
Based on the modelled conditions, the subacute NOEL of the test material in the rat was determined to be ca. 1080 mg/kg bw/day.
Key value for chemical safety assessment
Repeated dose toxicity: via oral route - systemic effects
Link to relevant study records
- Endpoint:
- repeated dose toxicity: oral, other
- Remarks:
- Both subchronic and subacute data were used in the prediction. As a worst case, the prediction is submitted as subacute toxicity data.
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Study period:
- 2018
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: The following prediction was performed using the OECD QSAR Toolbox using an appropriate category based on the current endpoint. The prediction was further refined using subcategories.
- Justification for type of information:
- The test material is a mixture of many substances. Comparison of all substances has shown that they are expected to have the same repeat dose toxicity. For the purpose of addressing the repeat dose endpoint the most concentrated component of the test material was assessed individually.
- Reason / purpose for cross-reference:
- other: read-across target
- Qualifier:
- according to guideline
- Guideline:
- other: REACH Guidance on QSARs R.6, May/July 2008
- Principles of method if other than guideline:
- The repeat dose oral toxicity of the test material was evaluated using a read-across approach. Suitable analogues were found in the OECD QSAR Toolbox using the Organic Functional Groups category, and the results were refined using relevant subcategories.
- GLP compliance:
- no
- Remarks:
- As no laboratory work took place, compliance with GLP is not required.
- Limit test:
- no
- Specific details on test material used for the study:
- SMILES: OCC[N+H](CCO)CCO.CCCCCCCC(=O)NC(CCC(O)=O)C([O-])=O
- Species:
- rat
- Strain:
- not specified
- Sex:
- not specified
- Route of administration:
- oral: unspecified
- Dose descriptor:
- NOEL
- Effect level:
- 1 080 mg/kg bw/day (nominal)
- Based on:
- test mat.
- Sex:
- not specified
- Basis for effect level:
- other: Based on the modelled conditions
- Remarks on result:
- not measured/tested
- Remarks:
- The prediction was based on the average value from the 4 nearest neighbours compared by prediction descriptors.
- Critical effects observed:
- not specified
- Conclusions:
- Based on the modelled conditions, the subacute NOEL of the test material in the rat was determined to be ca. 1080 mg/kg bw/day.
- Executive summary:
The repeat dose oral toxicity of the test material was evaluated using a read-across approach. Suitable analogues were found in the OECD QSAR Toolbox using the Organic Functional Groups profiler, and the results were refined using relevant subcategory (repeat dose (HESS)).
Based on the modelled conditions, the subacute NOEL of the test material in the rat was determined to be ca. 1080 mg/kg bw/day.
The target chemical falls within the applicability domain of the prediction.
- Endpoint:
- repeated dose toxicity: oral, other
- Remarks:
- Both subchronic and subacute data were used in the prediction. As a worst case, the prediction is submitted as subacute toxicity data.
- Type of information:
- read-across from supporting substance (structural analogue or surrogate)
- Adequacy of study:
- key study
- Justification for type of information:
- For the justification for read-across, please refer to the read-across assessment framework report that is attached to Section 13.
- Reason / purpose for cross-reference:
- read-across source
- Species:
- rat
- Strain:
- not specified
- Sex:
- not specified
- Route of administration:
- oral: unspecified
- Dose descriptor:
- NOEL
- Effect level:
- 1 080 mg/kg bw/day (nominal)
- Based on:
- test mat.
- Sex:
- not specified
- Basis for effect level:
- other: Based on the modelled conditions
- Remarks on result:
- not measured/tested
- Remarks:
- The prediction was based on the average value from the 4 nearest neighbours compared by prediction descriptors.
- Critical effects observed:
- not specified
- Conclusions:
- Based on the modelled conditions, the subacute NOEL of the test material in the rat was determined to be ca. 1080 mg/kg bw/day.
- Executive summary:
The repeat dose oral toxicity of the test material was evaluated using a read-across approach. Suitable analogues were found in the OECD QSAR Toolbox using the Organic Functional Groups profiler, and the results were refined using relevant subcategory (repeat dose (HESS)).
Based on the modelled conditions, the subacute NOEL of the test material in the rat was determined to be ca. 1080 mg/kg bw/day.
The target chemical falls within the applicability domain of the prediction.
Referenceopen allclose all
The prediction was based on dataset comprised from the following descriptors: NOEL
Estimation method: Takes average value from the 4 nearest neighbours
Domain logical expression: Result: In Domain
Substances used for the prediction should be:
Alcohol<OR>Ammonium salt<OR>Carboxylic acid<OR>Organic amide and thioamide (Organic functional groups)
Not categorized ( Repeated dose (HESS))
Alcohol; Ammonium salt; Carboxylic acid; Organic amide and thioamide (Organic functional groups)
Endpoint conclusion
- Endpoint conclusion:
- no adverse effect observed
Repeated dose toxicity: inhalation - systemic effects
Endpoint conclusion
- Endpoint conclusion:
- no study available
Repeated dose toxicity: inhalation - local effects
Endpoint conclusion
- Endpoint conclusion:
- no study available
Repeated dose toxicity: dermal - systemic effects
Endpoint conclusion
- Endpoint conclusion:
- no study available
Repeated dose toxicity: dermal - local effects
Endpoint conclusion
- Endpoint conclusion:
- no study available
Additional information
The repeat dose oral toxicity of the test material was evaluated using a read-across approach. Suitable analogues were found in the OECD QSAR Toolbox using the Organic Functional Groups profiler, and the results were refined using relevant subcategory (repeat dose (HESS)).
Based on the modelled conditions, the subacute NOEL of the test material in the rat was determined to be ca. 1080 mg/kg bw/day.
Justification for classification or non-classification
In accordance with the criteria for classification as defined in Annex I, Regulation (EC) No. 1272/2008 (CLP), the substance does not require classification with respect to Specific Target Organ Toxicity repeated dose (STOT RE) via the oral route.
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
Reproduction or further distribution of this information may be subject to copyright protection. Use of the information without obtaining the permission from the owner(s) of the respective information might violate the rights of the owner.