Registration Dossier
Registration Dossier
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EC number: 614-095-7 | CAS number: 676532-41-5
Vapour pressure
Administrative data
- Endpoint:
- vapour pressure
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Study period:
- June 2017
- 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:
- Results derived from a valid QSAR model
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 017
- Report date:
- 2017
Materials and methods
Test guideline
- Qualifier:
- according to guideline
- Guideline:
- other: EPI Suite Antoine method
- Deviations:
- no
- Principles of method if other than guideline:
- The MPBPWIN v1.43 module of the US Environmental Protection Agency EPI Suite 4.1 was used to calculate the vapour pressure of Toppynol. This software uses the Antoine method, the Modified Grain method and the Mackay method to calculate the vapour pressure.
- GLP compliance:
- not specified
- Type of method:
- other: QSAR
Test material
- Reference substance name:
- 3,5-dimethylhex-3-en-2-ol
- EC Number:
- 614-095-7
- Cas Number:
- 676532-41-5
- Molecular formula:
- C8H16O
- IUPAC Name:
- 3,5-dimethylhex-3-en-2-ol
- Test material form:
- liquid
Constituent 1
Results and discussion
Vapour pressureopen allclose all
- Key result
- Test no.:
- #1
- Temp.:
- 20 °C
- Vapour pressure:
- 37.9 Pa
- Key result
- Test no.:
- #2
- Temp.:
- 25 °C
- Vapour pressure:
- 57.9 Pa
Applicant's summary and conclusion
- Executive summary:
Vapour pressure of Secodemol (20oC) = 37.9 Pa (mean of Antoine and Grain methods);
Vapour pressure of Secodemol (25oC) = 57.9 Pa (mean of Antoine and Grain methods).
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