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Partition coefficient

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Reference
Endpoint:
partition coefficient
Type of information:
(Q)SAR
Adequacy of study:
key study
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 limited documentation / justification
Justification for type of information:
QSAR calculations applying the valid QSAR calculation tool EPI-Suite (EPIWEB v 4.1) were conducted based on the cas no: 97281-48-6
Qualifier:
according to
Guideline:
other: QSAR calculation
Version / remarks:
EPIWEB 4.1
Partition coefficient type:
octanol-water
Specific details on test material used for the study:
QSAR calculation based on CAS: 97281-48-6
Key result
Type:
log Pow
Partition coefficient:
13.77
Temp.:
25 °C
pH:
7
Remarks on result:
other: Temperature and pH is not reported. Ambient temperature of 25 C and pH of 7 are assumed
Conclusions:
QSAR calculations were applied to determine a Log Pow of 13.77
Executive summary:

QSAR calculations were applied to determine a Log Pow of 13.77

Description of key information

QSAR calculations were applied to determine a Log Pow of 13.77

Key value for chemical safety assessment

Log Kow (Log Pow):
13.77
at the temperature of:
25 °C

Additional information