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EC number: 251-090-5 | CAS number: 32539-83-6
Water solubility
Administrative data
- Endpoint:
- water solubility
- Type of information:
- calculation (if not (Q)SAR)
- Remarks:
- Migrated phrase: estimated by calculation
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: The result has been obtained by EPISUITE.
Data source
Reference
- Reference Type:
- secondary source
- Title:
- Unnamed
- Year:
- 2 009
Materials and methods
- Principles of method if other than guideline:
- The approach used in KowWin is based on atom/fragment contributions to the final result. In particular the Kow alghorithm uses a fragment method that gives a specific Log P value to each fragment and estimates a chemical's water solubility from this value.
- GLP compliance:
- no
- Type of method:
- other: calculated method according toKowWin of Episuite (developed by EPA-US)
Test material
- Reference substance name:
- 3,4,5,6,7,8,9,10,11,12,13,14-dodecahydro-2H-cyclododeca[b]pyran
- EC Number:
- 251-090-5
- EC Name:
- 3,4,5,6,7,8,9,10,11,12,13,14-dodecahydro-2H-cyclododeca[b]pyran
- Cas Number:
- 32539-83-6
- Molecular formula:
- C15H26O1
- IUPAC Name:
- 2H,3H,4H,5H,6H,7H,8H,9H,10H,11H,12H,13H,14H-cyclododeca[b]pyran
Constituent 1
Results and discussion
Water solubility
- Water solubility:
- ca. 0.386 mg/L
- Temp.:
- 25 °C
- Remarks on result:
- other: EPISUITE does not report the pH value for the calculation of the water solubility.
Applicant's summary and conclusion
- Conclusions:
- Interpretation of results (migrated information): slightly soluble (0.1-100 mg/L)
The test material water solubility is 0.386 mg/L by calculation using the KowWin module of EPISUITE. - Executive summary:
The test material water solubility is 0.386 mg/L and was obtained by calculation using the KowWin module of EPISUITE.
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