Registration Dossier
Registration Dossier
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EC number: 226-237-1 | CAS number: 5332-24-1
Partition coefficient
Administrative data
Link to relevant study record(s)
- Endpoint:
- partition coefficient
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- data from handbook or collection of data
- Justification for type of information:
- Data is from authoritative databases.
- Qualifier:
- according to guideline
- Guideline:
- other: As mention below
- Principles of method if other than guideline:
- To estimate octanol water partition coefficient of the 3-Bromoquinoline (5332-24-1).
- GLP compliance:
- not specified
- Other quality assurance:
- other: No data
- Type of method:
- other: No data
- Partition coefficient type:
- octanol-water
- Specific details on test material used for the study:
- - Common name: 3-Bromoquinoline
- Molecular formula: C9H6BrN
- Molecular weight: 208.057 g/mole
- Smiles notation: c12c(ncc(c1)Br)cccc2
- InChl: 1S/C9H6BrN/c10-8-5-7-3-1-2-4-9(7)11-6-8/h1-6H
- Substance type: Organic
- Physical state: Liquid - Key result
- Type:
- log Pow
- Partition coefficient:
- 3.03
- Remarks on result:
- other: Other details not known
- Details on results:
- The log Kow of test chemical 3-Bromoquinoline was determined to be 3.03.
- Conclusions:
- The partition coefficient (log Kow) of test chemical 3-Bromoquinoline was determined to be 3.03.
- Executive summary:
The partition coefficient (log Kow) of test chemical 3-Bromoquinoline was determined to be 3.03. Based on the experimental data chemical 3-Bromoquinoline can be considered to be hydrophilic in nature.
Reference
Description of key information
The partition coefficient (log Kow) of test chemical 3-Bromoquinoline was determined to be 3.03. Based on the experimental data chemical 3-Bromoquinoline can be considered to be hydrophilic in nature.
Key value for chemical safety assessment
- Log Kow (Log Pow):
- 3.03
Additional information
Based on the available data in a key study from handbook, authoritative and modeling databases, the octanol water partition coefficient (log Pow) value of the test substance 3-Bromoquinoline (5332-24-1) was estimated to be 3.03.
In a supporting study from secondary source and predicted data, the partition coefficient (log Kow) of test chemical 3-Bromoquinoline was determined to be 3.03 ±0.29. Based on the predicted data chemical 3-Bromoquinoline can be considered to be hydrophilic in nature.
Thus based on the predicted and experimental data it was concluded that the chemical was hydrophilic in nature.
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