Registration Dossier
Registration Dossier
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EC number: 261-118-8 | CAS number: 58096-47-2
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- calculation (if not (Q)SAR)
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- accepted calculation method
Data source
Reference
- Reference Type:
- other: Estimated data
- Title:
- Estimation of partition coefficient
- Author:
- United States Environmental Protection Agency, Washington, DC, USA.
- Year:
- 2 017
- Bibliographic source:
- Estimation Programs Interface Suite
Materials and methods
Test guideline
- Qualifier:
- no guideline followed
- Principles of method if other than guideline:
- Estimated value of partition co-efficient using EPI Suite model develeoped by USEPA
- GLP compliance:
- no
- Other quality assurance:
- other: EPI Suite model developed by USEPA
- Type of method:
- other: WSKOW v1.42
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- Decahydro-1,1,7-trimethyl-3a,7-methano-3aH-cyclopentacyclooct-3-yl formate
- EC Number:
- 261-118-8
- EC Name:
- Decahydro-1,1,7-trimethyl-3a,7-methano-3aH-cyclopentacyclooct-3-yl formate
- Cas Number:
- 58096-47-2
- Molecular formula:
- C16H26O2
- IUPAC Name:
- decahydro-1,1,7-trimethyl-3a,7-methano-3aH-cyclopentacyclooct-3-yl formate
- Test material form:
- liquid
Constituent 1
- Specific details on test material used for the study:
- CAS No: 58096-47-2
EC No: 261-118-8
Chemical Name: Decahydro-1,1,7-trimethyl-3a,7-methano-3aH-cyclopentacyclooct-3-yl formate
Trade Name: Clovanyl-3-Formate (CARYOLAN)
Molecular formula: C16H26O2
Molecular weight: 250.379
Results and discussion
Partition coefficient
- Key result
- Type:
- log Pow
- Partition coefficient:
- 4.86
- Temp.:
- 25 °C
- Remarks on result:
- other: EPI Suite
Applicant's summary and conclusion
- Conclusions:
- The estimated value of octanol water partition coefficient (Log Pow) of Decahydro-1,1,7-trimethyl-3a,7-methano-3aH-cyclopentacyclooct-3-yl formate, using the EPI Suite model was 4.86 at 25oC.
- Executive summary:
The estimated value of octanol water partition coefficient (Log Pow) of Decahydro-1,1,7-trimethyl-3a,7-methano-3aH-cyclopentacyclooct-3-yl formate, using the EPI Suite model was 4.86 at 25oC.
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