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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
Reference:
Composition 0
Qualifier:
according to
Guideline:
other: estimated data
Principles of method if other than guideline:
WSKOW v1.42 was used to estimate the water solubility of Aluminum, 2-(1,3-dihydro-1,3-dioxo-2H-inden-2-ylidene)-1,2-dihydro-6,7-quinolinedisulfonate complexes.
GLP compliance:
not specified
Type of method:
other: estimated data
Test material information:
Composition 1
Specific details on test material used for the study:
- Name of test material : Aluminum, 2-(1,3-dihydro-1,3-dioxo-2H-inden-2-ylidene)-1,2-dihydro-6,7-quinolinedisulfonate complexes
- Molecular formula : C18H11NO8S2.Al
- Molecular weight : 460.39 g/mol
- Smiles notation : O=C1c2ccccc2C(=O)C1=C1C=Cc2cc3c4cc2N{-}1.[Al]{3+}(.O{-}S3(=O)=O).O{-}S4(=O)=O
- Substance type : Organic
- Physical state : Solid
Key result
Water solubility:
2.2 mg/L
Conc. based on:
test mat.
Temp.:
25 °C
Remarks on result:
other: Estimated value
Conclusions:
The estimated water solubility of Aluminum, 2-(1,3-dihydro-1,3-dioxo-2H-inden-2-ylidene)-1,2-dihydro-6,7-quinolinedisulfonate complexes at 25 deg C was 2.20 mg/l.
Executive summary:

WSKOW v1.42 was used to estimate the water solubility of Aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes.

The estimated water solubility of Aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes at 25 deg C was 2.20 mg/l.

Based on the estimated value, Aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes was slightly soluble in water.

Description of key information

The estimated water solubility of Aluminum, 2-(1,3-dihydro-1,3-dioxo-2H-inden-2-ylidene)-1,2-dihydro-6,7-quinolinedisulfonate complexes at 25 deg C was 2.20 mg/l.

Key value for chemical safety assessment

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

Additional information

WSKOW v1.42 was used to estimate the water solubility of Aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes.

The estimated water solubility of Aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes at 25 deg C was 2.20 mg/l.

Based on the estimated value, Aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes was slightly soluble in water.