Registration Dossier
Registration Dossier
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EC number: 211-443-6 | CAS number: 645-45-4
Water solubility
Administrative data
Link to relevant study record(s)
- Endpoint:
- water solubility
- Type of information:
- calculation (if not (Q)SAR)
- Adequacy of study:
- supporting study
- Reliability:
- 4 (not assignable)
- Rationale for reliability incl. deficiencies:
- secondary literature
- Justification for type of information:
- Estimated data
- Qualifier:
- according to guideline
- Guideline:
- other: As mention below
- Principles of method if other than guideline:
- Determine the water solubility of the 3-phenylpropanoyl chloride
- GLP compliance:
- no
- Type of method:
- other: Estimated data
- Specific details on test material used for the study:
- - Name of test material : 3-phenylpropanoyl chloride- Molecular formula : C9H9ClO- Molecular weight : 168.622 g/mol- Smiles notation : c1cc(CCC(Cl)=O)ccc1- InChl : MFEILWXBDBCWKF-UHFFFAOYSA-N- Substance type: Organic- Physical state: Liquid
- Key result
- Water solubility:
- 2 090 mg/L
- Temp.:
- 25 °C
- Conclusions:
- Water solubility of the 3-phenylpropanoyl chloride from above source is determined to be 2090 mg/L at 25 Deg C
- Executive summary:
Water solubility of the 3-phenylpropanoyl chloride from above source is determined to be 2090 mg/L at 25 Deg C
Reference
Description of key information
Water solubility of the 3-phenylpropanoyl chloride from above study is determined to be 2092 mg/L at 25 Deg C
Key value for chemical safety assessment
- Water solubility:
- 2 092 mg/L
- at the temperature of:
- 25 °C
Additional information
WSKOW v1.42 was used to estimate the water solubility of the 3 phenylpropionylchloride
The estimated water solubility of the 3 phenylpropionylchloride at 25 deg C was 2092 mg/l
Based on the estimated value, the 3 phenylpropionylchloride was soluble in water.
Water solubility of the 3 -phenylpropanoyl chloride from above source & study is determined to be 2090 mg/L at 25 Deg C
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