Registration Dossier
Registration Dossier
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EC number: 201-969-4 | CAS number: 90-15-3
Water solubility
Administrative data
Link to relevant study record(s)
- Endpoint:
- water solubility
- Type of information:
- calculation (if not (Q)SAR)
- Adequacy of study:
- weight of evidence
- 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
- Remarks:
- standard organic molecule that should be within the validity set of the model for water solubility, results are similar to reported publication results
- Principles of method if other than guideline:
- calculated
- Type of method:
- other: calculated
- Water solubility:
- 1 126 mg/L
- Temp.:
- 25 °C
- Remarks on result:
- other: Kow method
- Water solubility:
- 1 244.5 mg/L
- Temp.:
- 25 °C
- Remarks on result:
- other: fragment method
- Conclusions:
- calculated water solubility is 1126-1244.5 mg/L @ 25 oC (Kow method - fragment method), similar to reported publication values
- Executive summary:
calculated water solubility is 1126-1244.5 mg/L @ 25 oC (Kow method - fragment method), similar to reported publication values
- Endpoint:
- water solubility
- Type of information:
- experimental study
- Adequacy of study:
- weight of evidence
- Reliability:
- 4 (not assignable)
- Rationale for reliability incl. deficiencies:
- documentation insufficient for assessment
- Remarks:
- no method information
- Principles of method if other than guideline:
- no method information
- Type of method:
- other: no method information
- Water solubility:
- 0.96 g/L
- Temp.:
- 15 °C
- pH:
- 6
- Water solubility:
- 1.11 g/L
- Temp.:
- 20 °C
- pH:
- 6
- Water solubility:
- 1.25 g/L
- Temp.:
- 23.8 °C
- pH:
- 6
- Water solubility:
- 1.43 g/L
- Temp.:
- 28.5 °C
- pH:
- 6
- Conclusions:
- reported water solubility is 1.11 g/L @ 20 oC
- Executive summary:
reported water solubility is 1.11 g/L @ 20 oC
- Endpoint:
- water solubility
- Type of information:
- experimental study
- Adequacy of study:
- weight of evidence
- Reliability:
- 4 (not assignable)
- Rationale for reliability incl. deficiencies:
- documentation insufficient for assessment
- Remarks:
- no method information
- Principles of method if other than guideline:
- no method information
- Type of method:
- other: no method information
- Water solubility:
- 0.008 other: M
- Temp.:
- 20 °C
- Remarks on result:
- other: corresponds to 1.11 g/L
- Conclusions:
- reported water solublity is 0.0077 M @ 20 oC (corresponds to 1.11 g/L)
- Executive summary:
reported water solublity is 0.0077 M @ 20 oC (corresponds to 1.11 g/L)
Referenceopen allclose all
Description of key information
Weight of evidence of two publications and EpiWin calculation
Key value for chemical safety assessment
- Water solubility:
- 1.11 g/L
- at the temperature of:
- 20 °C
Additional information
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