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Environmental fate & pathways

Adsorption / desorption

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Reference
Endpoint:
adsorption / desorption: screening
Type of information:
experimental study
Adequacy of study:
key study
Study period:
Between 29 July 1999 and 15 December 1999.
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
guideline study
Reason / purpose for cross-reference:
reference to same study
Reason / purpose for cross-reference:
reference to same study
Reason / purpose for cross-reference:
reference to same study
Reason / purpose for cross-reference:
reference to same study
Reason / purpose for cross-reference:
reference to same study
Reason / purpose for cross-reference:
reference to same study
Qualifier:
according to guideline
Guideline:
OECD Guideline 121 (Estimation of the Adsorption Coefficient (Koc) on Soil and on Sewage Sludge using High Performance Liquid Chromatography (HPLC))
Version / remarks:
OECD draft document (December 1998): Estimation of the Adsorption Coefficient (Koc) on Soil and on Sewage Sludge using High Performance Liquid Chromatography (HPLC).
Deviations:
not specified
GLP compliance:
yes (incl. QA statement)
Type of method:
HPLC estimation method
Media:
other: Not required
Specific details on test material used for the study:
No further details specified in the study report.
Radiolabelling:
no
Test temperature:
Column temperature: 30°C
Details on study design: HPLC method:
Procedure
Preparation of sample solution
Test material (0.1000 g) was diluted to 100 ml with methanol.

Preparation of reference solutions
The dead time was determined by measuring the retention time of formamide (purity 99.5%, 735 mg/l solution in methanol).

Determination of retention time
The sample, formamide and reference standard solutions were injected in duplicate using the following HPLC parameters:

HPLC system: Hewlett-Packard 1050, incorporating autosampler and workstation
Column: Hypersil 5μ CN-BDS (250 mm x 4.6 mm id)
Column temperature: 30 °C
Mobile phase: methanol: water (55.45 v/v)
pH of mobile phase: 7.01
Flow-rate: 1 ml/min
UV detector wavelength: dead time and reference standards: 210 nm; sample: 217 nm
Injection volume: 10 μl

Construction of calibration curve
A calibration curve was constructed from the retention time data of the formamide and reference standard solutions. The capacity factors (k) for the reference standards were calculated.

Adsorption coefficient sf sample
The capacity factor was calculated using the log10 Koc value determined with reference to the calibration curve.
Key result
Type:
log Koc
Value:
3.63 dimensionless
pH:
7.01
Temp.:
30 °C
Key result
Type:
Koc
Value:
4 240 dimensionless
pH:
7.01
Temp.:
30 °C
Details on results (HPLC method):
The draft document states that the measurement of adsorption coefficient should be carried out on substances in their ionised and unionised forms. However, the dissociation constant of APAN made it impossible to satisfy this criteria. Testing would be required at pH 0.6 or below for the material to be ionised which is outside the environmental pH range for this test.

The retention times of formamide and the reference standards

Dead time

Retention time (mins)

Mean retention time (mins)

Injection 1

Injection 2

Formamide

3.285

3.287

3.286

 

Standard

Retention time (mins)

Mean retention time (mins)

Injection 1

Injection 2

Acetanilide

3.576

3.573

3.575

Phenol

3.532

3.532

3.532

Atrazine

4.087

4.088

4.088

Isoproturon

4.293

4.295

4.294

Naphthalene

5.403

5.401

5.402

Fenthion

7.680

7.667

7.674

Pyrazophos

9.391

9.388

9.390

αEndosulfan

16.079

16.151

16.115

Phenanthrene

9.996

10.000

9.998

Diclofop-methyl

15.719

15.712

15.716

DDT

53.842

53.931

53.887

 

The capacity factor (k) and log10 Koc values for the reference standards

Standard

Capacity Factor (k)

Log10 k

Log10 Koc

Acetanilide

8.780 x 10-2

-1.057

1.25

Phenol

7.486 x 10-2

-1.126

1.32

Atrazine

0.244

-0.613

1.81

Isoproturon

0.307

-0.513

1.86

Naphthalene

0.644

-0.191

2.75

Fenthion

1.335

0.126

3.31

Pyrazophos

1.857

0.269

3.65

αEndosulfan

3.904

0.592

4.09

Phenanthrene

2.043

0.310

4.09

Diclofop-methyl

3.783

0.578

4.20

DDT

15.399

1.187

5.63

 

The retention times, capacity factors and log10 Koc values determined for the sample

Injection

Retention time (mins)

Capacity factor (k)

Log10 k

Log10 Koc

1

8.965

1.728

0.238

3.63

2

8.945

1.722

0.236

3.63

Overall log10 Koc: 3.63

Adsorption coeifficent: 4.24 x 103

Validity criteria fulfilled:
not specified
Conclusions:
The adsorption coefficient (Koc) of APAN has been determined to be 4.24 x 103, log10 Koc 3.63.
Executive summary:

Adsorption coefficient determined as 4.24 x 103, log10 Koc 3.63, using the OECD draft document (December 1998): Estimation of the Adsorption Coefficient (K,) on Soil and on Sewage Sludge using High Performance Liquid Chromatography (HPLC).

Description of key information

Adsorption coefficient determined as 4.24 x 103, log10 Koc 3.63

Key value for chemical safety assessment

Koc at 20 °C:
4 240

Additional information

Adsorption coefficient determined as 4.24 x 103, log10 Koc 3.63, using the OECD draft document (December 1998): Estimation of the Adsorption Coefficient (K,) on Soil and on Sewage Sludge using High Performance Liquid Chromatography (HPLC).

[LogKoc: 3.63]