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Physical & Chemical properties

Water solubility

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Reference
Endpoint:
water solubility
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
data is from modelling database
Qualifier:
according to
Guideline:
other: as mentioned below
Principles of method if other than guideline:
WSKOW v1.42 was used to estimate the water solubility of the test chemical.
GLP compliance:
no
Type of method:
other: estimated data
Specific details on test material used for the study:
- Name of test material : 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxy-3H-spiro[2-benzofuran-1,9'-xanthene]-3-one
- Molecular formula : C20H4Br4Cl4O5
- Molecular weight : 785.6746 g/mol
- Smiles notation : c1c2c(c(c(c1Br)O)Br)Oc3c(cc(c(c3Br)O)Br)C24c5c(c(c(c(c5Cl)Cl)Cl)Cl)C(=O)O4
- InChl: 1S/C20H4Br4Cl4O5/c21-5-1-3-17(9(23)15(5)29)32-18-4(2-6(22)16(30)10(18)24)20(3)8-7(19(31)33-20)11(25)13(27)14(28)12(8)26/h1-2,29-30H
- Substance type:Organic
- Physical state:Solid
Key result
Water solubility:
ca. 0 mg/L
Conc. based on:
test mat.
Temp.:
25 °C
Remarks on result:
other: estimated value
Conclusions:
The estimated water solubility of the test chemical at 25 deg C was 2.178e-008 mg/l
Executive summary:

Based on the estimation done using WSKOW v1.42 the water solubility of the test chemical was estimated to be 2.178e-008 mg/L

Based on the above estimated value, the test substance was observed to be insoluble in water.

Description of key information

Based on the estimation done using WSKOW v1.42 the water solubility of the test chemical was estimated to be 2.178e-008 mg/L.

Based on the above estimated value, the test substance was observed to be insoluble in water.

Key value for chemical safety assessment

Water solubility:
0 mg/L
at the temperature of:
25 °C

Additional information

Based on the estimation done using WSKOW v1.42 the water solubility of the test chemical was estimated to be 2.178e-008 mg/L.

Based on the above estimated value, the test substance was observed to be insoluble in water.