Registration Dossier
Registration Dossier
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EC number: 601-332-4 | CAS number: 114882-16-5
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- calculation (if not (Q)SAR)
- Remarks:
- Migrated phrase: estimated by calculation
- Adequacy of study:
- other information
- Reliability:
- 4 (not assignable)
- Rationale for reliability incl. deficiencies:
- other: Secondary source: estimated by calculation
Data source
Reference
- Reference Type:
- secondary source
- Title:
- Partition coefficient
- Author:
- KOWWIN v1.68
- Bibliographic source:
- Episuite v 4.11
Materials and methods
Test guideline
- Qualifier:
- no guideline available
- GLP compliance:
- no
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- (8S,10S,13S,14S,17R)-17-hydroxy-10,13-dimethyl-1,2,4,7,8,10,12,13,14,15,16,17-dodecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolane]-17-carbonitrile
- EC Number:
- 601-332-4
- Cas Number:
- 114882-16-5
- Molecular formula:
- C22H29NO3
- IUPAC Name:
- (8S,10S,13S,14S,17R)-17-hydroxy-10,13-dimethyl-1,2,4,7,8,10,12,13,14,15,16,17-dodecahydrospiro[cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolane]-17-carbonitrile
Constituent 1
Results and discussion
Partition coefficient
- Type:
- log Pow
- Partition coefficient:
- 4.77
Applicant's summary and conclusion
- Conclusions:
- The estimated log Pow of the substance is 4.77
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