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Diss Factsheets

Physical & Chemical properties

Water solubility

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Administrative data

Endpoint:
water solubility
Type of information:
experimental study
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
guideline study with acceptable restrictions

Data source

Reference
Reference Type:
study report
Title:
Unnamed
Year:
2017
Report date:
2017

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
OECD Guideline 105 (Water Solubility)
Deviations:
no
GLP compliance:
no
Type of method:
column elution method

Test material

Constituent 1
Chemical structure
Reference substance name:
bis(N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfanyl]-2-hydroxy-2-methylpropanamide)
EC Number:
618-533-8
Cas Number:
90356-78-8
Molecular formula:
C18H14F4N2O2S
IUPAC Name:
bis(N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfanyl]-2-hydroxy-2-methylpropanamide)
Test material form:
solid: crystalline
Details on test material:
Test item: B-SulphenylCAS number: 90356-78-8Batch number: 235100NPhysical state: Solid, crystalline substanceColour: Creamy whiteActive ingredient content: ca. 99%Storage: At a temperature of 15 to 30 °C, protected from light and moisture

Results and discussion

Water solubility
Key result
Water solubility:
0.005 g/L
Conc. based on:
test mat.
Incubation duration:
72 h
Temp.:
24.5 °C
pH:
6
Details on results:
The serial numbers of samples which were taken into considerations for calculation of solubility: 8-12.
The difference between the lowest and highest concentration values was 11.3% which is less than 30% so this test was valid.
The calculated mean solubility for the first run: 0.00476 g/L (4.76 mg/L)
The standard deviation (SD) for the first run: 0.00020 g/L (0.2 mg/L).
The coefficient of variation (CV) for the first run: 4.1%
The temperature of the circulated solution was 24.5 °C.
The pH of the solution was 6 (measured by indicator paper).

Applicant's summary and conclusion

Conclusions:
The water solubility of B-sulphenyl is 0.00462 g/l.