Registration Dossier
Registration Dossier
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EC number: 224-137-2 | CAS number: 4210-32-6
Partition coefficient
Administrative data
Link to relevant study record(s)
- Endpoint:
- partition coefficient
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Study period:
- October 2014
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- results derived from a valid (Q)SAR model and falling into its applicability domain, with adequate and reliable documentation / justification
- Justification for type of information:
- QSAR prediction
- Qualifier:
- no guideline followed
- Principles of method if other than guideline:
- QSAR calculations
- Key result
- Type:
- log Pow
- Partition coefficient:
- ca. 3.49
- Remarks on result:
- other: Mean value of the calcualtion with different QSAR models.
- Conclusions:
- A mean value for the log Kow of 4-tert-Butylbenzonitrile was determined by the calculation with different QSAR models to be 3.49.
- Executive summary:
A mean value for the log Kow of 4-tert-Butylbenzonitrile was determined by the calculation with different QSAR models to be 3.49.
Reference
Description of key information
A mean value for the log Kow of 4-tert-Butylbenzonitrile was determined by the calculation with different QSAR models
to be 3.49.
Key value for chemical safety assessment
- Log Kow (Log Pow):
- 3.49
Additional information
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