Registration Dossier
Registration Dossier
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EC number: 827-072-3 | CAS number: 100074-94-0
Acute Toxicity: oral
Administrative data
- Endpoint:
- acute toxicity: oral
- Type of information:
- (Q)SAR
- Adequacy of study:
- weight of evidence
- Study period:
- December 2018
- Reliability:
- 1 (reliable without restriction)
- 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
Data source
Reference
- Title:
- T.E.S.T (Toxicity Estimation Software Tool) v4.2.1
- Year:
- 2 016
- Bibliographic source:
- Model developed by U.S. EPA/National Risk Management Research Laboratory/Sustainable Technology Division
Materials and methods
Test guideline
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 423 (Acute Oral toxicity - Acute Toxic Class Method)
- GLP compliance:
- not specified
Test material
- Reference substance name:
- 3-~{O}-(2-ethoxy-2-oxoethyl) 1-~{O}-ethyl propanedioate
- Cas Number:
- 100074-94-0
- Molecular formula:
- C9H14O6
- IUPAC Name:
- 3-~{O}-(2-ethoxy-2-oxoethyl) 1-~{O}-ethyl propanedioate
Constituent 1
- Specific details on test material used for the study:
- SMILES: CCOC(=O)CC(=O)OCC(=O)OCC
Test animals
- Species:
- rat
Results and discussion
Effect levels
- Key result
- Dose descriptor:
- LD50
- Effect level:
- 7 285.85 mg/kg bw
- Remarks on result:
- other: QSAR predicted value
Applicant's summary and conclusion
- Interpretation of results:
- GHS criteria not met
- Conclusions:
- The estimated value for 2-ethoxy-2-oxoethyl ethyl malonate applying TEST models for LD50 (oral) was 7285.85 mg/kg bw (>2000 mg/kg bw). The prediction, falls inside the applicability domain of the model and is considered reliable.
CLP criteria are not met. - Executive summary:
Regulatory purpose: This study was designed to generate estimated in silico (nontesting) data for acute oral toxicity in rat for 2-ethoxy-2-oxoethyl ethyl malonate to be used in the regulatory framework of REACH.
LD50 (oral) = 7285.85 mg/kg bw.
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