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Physical & Chemical properties

Water solubility

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Endpoint:
water solubility
Type of information:
experimental study
Adequacy of study:
key study
Study period:
From May to November 2007
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
other: Study guidelines
Qualifier:
according to guideline
Guideline:
EPA OPPTS 830.7860 (Water Solubility Generator Column Method)
Qualifier:
according to guideline
Guideline:
OECD Guideline 105 (Water Solubility)
GLP compliance:
yes (incl. QA statement)
Type of method:
column elution method
Water solubility:
0.032 µg/L
Temp.:
20 °C
pH:
7
Remarks on result:
other: solubility of the testing substance was 0.0319± 0.00392 μg a.i./L (n = 5, CV = 12.3%).
Details on results:
Under the experimental conditions presented, the mean water solubility for AN2 was 0.0319± 0.00392 μg a.i./L (n = 5, CV = 12.3%). The percent difference in calculated solubility for collected samples was 25.1%.
Conclusions:
Interpretation of results (migrated information): insoluble (< 0.1 mg/L)
The water solubility of 4,4'-METHYLENEBIS (2,6-DI-TERT-BUTYLPHENOL) was determined using the generator column method. Under the experimental conditions presented, the mean water solubility for the testing substance was 0.0319 ± 0.00392 μg a.i./L (n = 5, CV = 12.3%).
Endpoint:
water solubility
Type of information:
experimental study
Adequacy of study:
key study
Study period:
10 February 2005-18 March 2005
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
other: Guideline Study
Qualifier:
according to guideline
Guideline:
OECD Guideline 105 (Water Solubility)
Deviations:
no
Qualifier:
according to guideline
Guideline:
EPA OPPTS 830.7840 (Water Solubility)
Deviations:
no
Qualifier:
according to guideline
Guideline:
EU Method A.6 (Water Solubility)
Deviations:
no
Qualifier:
according to guideline
Guideline:
other: as cited in US CFR 799.6784
Deviations:
no
GLP compliance:
yes (incl. QA statement)
Type of method:
column elution method
Water solubility:
< 0 g/L
Temp.:
20 °C
pH:
>= 5.6 - <= 7

Results:

Preliminary Test:

The preliminary estimate of water solubility was <0.457 mg/L.

Definitive Test:

The mean peak areas relating to the standard and sample solutions are shown in the following table:

Solution

Mean Peak Area

Standard 10.1 mg/L

267.173

Standard 10.0 mg/L

277.854

Sample 2A

8.517

Sample 2B

3.415

Standard 10.1 mg/L

275.944

Standard 10.0 mg/L

275.324

Sample 3A

3.565

Sample 3B

0.276

Standard 10.1 mg/L

271.741

Standard 10.0 mg/L

286.113

Sample 4A

3.009

Sample 4B

1.426

Standard 10.8 mg/L

302.535

Standard 10.3 mg/L

285.763

Sample 5A

0.817

Sample 5B

1.056

Standard 10.0 mg/L

248.735

Standard 10.1 mg/L

276.669

Sample 6A

4.060

Sample 6B

2.163

Sample 1 was omitted as not enough sample remained for analysis after centrifugation.

The concentration (g/L) of test material in the sample solution is shown in the following table:

Sample Number

Sampling Time (hour)

Concentration (g/L)

Solution pH

DeterminationA

DeterminationB

DeterminationA

DeterminationB

DeterminationA

DeterminationB

1

189

189.75

*

*

7.0

6.9

2

211.5

211.75

1.57 x 10-5†

6.30 x 10-6

6.9

6.6

3

234

234.25

6.49 x 10-6

5.03 x 10 -7

6.4

6.3

4

265.75

265.75

5.48 x 10-6

2.60 x 10-6

5.6

5.8

5

286.75

287

1.47 x 10-6

1.90 x 10-6

5.9

5.9

6

306

306.5

7.78 x 10-6

4.15 x 10-6

5.9

6.0

* Sample 1 not analyzed due to insufficient aliquot after centrifugation.

† Sample 2A not included in calculation of overall results.

The overall results are shown in the following table:

Determination

Mean Concentration (g/L)

A

<1.0 x 10-5

B

<1.0 x 10-5

Overall

<1.0 x 10-5

Validation:

The linearity of the detector response with respect to concentration was assessed over the nominal concentration range of 0 to 20 mg/L. This was satisfactory with a correlation coefficient of 1.000 being obtained. Recovery of analysis of the sample procedure was assessed and proved adequate for the test. Recovery data is shown in the following table:

Nominal concentration(mg/L)

Recovery range (%)

Mean recovery (%)

0.5

102-104

103

0.05

92.1-107

98.1

0.01

140-148

144

Conclusions:
Interpretation of results (migrated information): insoluble (< 0.1 mg/L)
The water solubilty of the test material has been determined to be less than 1.0 x 10e-5 g/L of solution at 10.0 + or - 0.5 degree C.
Executive summary:
Water Solubility.Less than 1.0 x 10-5g/L of solution at 20±0.5°C, using the column elution method:

* Method A6 of Commission Directive 92/69/EEC.

* Method 105 of the OECD Guidelines for Testing of Chemicals, 27 July 1995.

* Method 830.7840 of the OPPTS Guidelines.

* Method 40 CFR 799.6784.
Endpoint:
water solubility
Type of information:
experimental study
Adequacy of study:
key study
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
other: EU method and GLP study.
Qualifier:
according to guideline
Guideline:
EU Method A.6 (Water Solubility)
Deviations:
no
GLP compliance:
yes
Type of method:
column elution method
Water solubility:
< 0 g/L
Temp.:
20 °C
pH:
8.66
Details on results:
The water solubility of the test substance was determined as less than the detection limit for the method of analysis, based on the concentration of the lowest calibration standard, i.e. < 2.15 x 10-5 g/l at 20 ºC.
Conclusions:
Interpretation of results (migrated information): insoluble (< 0.1 mg/L)
The water solubility of the test substance was determined as less than the detection limit for the method of analysis, based on the concentration of the lowest calibration standard, i.e. < 2.15 x 10-5 g/l at 20 ºC.
Executive summary:

The water solubility was determined according to EU method A.6 to be less than the detection limit for the method of analysis, based on the concentration of the lowest calibration standard, i.e. < 2.15 x 10 -5 g/L at 20 ºC.

Description of key information

Key study: experimental results: GLP study. OECD 105 the water solubility of the test substance was 0.0319± 0.00392 μg a.i./L (n = 5, CV = 12.3%). At 20 deg. C

Key value for chemical safety assessment

Water solubility:
0.032 µg/L
at the temperature of:
20 °C

Additional information

Key study: experimental results: GLP study. OECD 105 the water solubility of the test substance was 0.0319± 0.00392 μg a.i./L (n = 5, CV = 12.3%). At 20 deg. C