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Registration Dossier
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EC number: 700-265-9 | CAS number: 2629-68-7
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- calculation (if not (Q)SAR)
- Remarks:
- Migrated phrase: estimated by calculation
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
Data source
Reference
- Reference Type:
- other company data
- Title:
- Unnamed
Materials and methods
- GLP compliance:
- no
- Type of method:
- other: Estimation
- Partition coefficient type:
- octanol-water
Test material
Reference
- Name:
- Unnamed
- Type:
- Constituent
Results and discussion
Partition coefficientopen allclose all
- Type:
- log Pow
- Partition coefficient:
- 4.37
- Type:
- log Pow
- Partition coefficient:
- 4.18
- Type:
- log Pow
- Partition coefficient:
- 3.93
Any other information on results incl. tables
Log(p) 4.37
St. .deviation: 0.47
by Crippents fragmentation: J.Chem.Inf.Comput.Sci.,27,2].(1987)
Log(p) 4,18
St. .deviation.: 0.49
by Viswanadhans fragmentation: J.Chem.Inf.Contput.Sci.,29,163(1989)
Estimation using Brotos fragmentation method
Log(p) . 3.93
St. .deviation: 0.42
by Brotos method: Eur.J.Ned.Chem. Chim.Theor.,19,71 (1984)
Applicant's summary and conclusion
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Reproduction or further distribution of this information may be subject to copyright protection. Use of the information without obtaining the permission from the owner(s) of the respective information might violate the rights of the owner.
