Registration Dossier
Registration Dossier
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EC number: 225-767-0 | CAS number: 5063-03-6
Density
Administrative data
- Endpoint:
- relative density
- 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:
- Documentation about the justification is provided in attachment (See Supporting information). The reliability assessment of the prediction is presented in the attached document as well (QPRF)
Data source
Reference
- Reference Type:
- other: QSAR
- Title:
- TEST
- Year:
- 2 022
- Bibliographic source:
- Density - Lookchem.com. http://www.lookchem.com
Materials and methods
Test guideline
- Qualifier:
- equivalent or similar to guideline
- Guideline:
- other:
- Version / remarks:
- ECHA guidance on information requirements and chemical safety assessment Chapter R.6: QSARs and grouping of chemicals.
- Principles of method if other than guideline:
- - Software tool(s) used including version: T.E.ST. Version 5.1.1
- Model(s) used: Consensus method
- Model description: see field 'Attached justification'
- Justification of QSAR prediction: see field 'Attached justification'
Test material
- Reference substance name:
- Methyl (8,9,10-trinorborn-5-en-2-yl) ketone
- EC Number:
- 225-767-0
- EC Name:
- Methyl (8,9,10-trinorborn-5-en-2-yl) ketone
- Cas Number:
- 5063-03-6
- Molecular formula:
- C9H12O
- IUPAC Name:
- 1-{bicyclo[2.2.1]hept-5-en-2-yl}ethan-1-one
Constituent 1
Results and discussion
Densityopen allclose all
- Key result
- Type:
- relative density
- Density:
- ca. 1.02
- Remarks on result:
- other: in silico data
- Key result
- Type:
- density
- Density:
- 1.02 g/cm³
- Remarks on result:
- other: in silico data
Any other information on results incl. tables
The prediction was deemed to be reliable on the basis of the parameters listed above. The molecule falls into the applicability domain of the model.
Applicant's summary and conclusion
- Conclusions:
- The density of the substance was predicted to be 1.02 kg/L.
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