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N-(1,3-Dimethylbutyl)-N

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OECD SIDS<br />

N-(1,3-DIMETHYLBUTYL)-N´-PHENYL-1,4-PHENYLENEDIAMINE<br />

3. ENVIRONMENTAL FATE AND PATHWAYS ID: 793-24-8<br />

DATE: 11.05.2005<br />

3.3.1 TRANSPORT BETWEEN ENVIRONMENTAL COMPARTMENTS<br />

3.3.2 DISTRIBUTION<br />

Media : air - biota - sediment(s) - soil - water<br />

Method : Calculation according Mackay, Level I<br />

Year : 2003<br />

Method : Data used in the calculation:<br />

Temperature (°C): 20<br />

Molar Mass (g/mol): 268.5<br />

Vapor pressure (Pa): 6.85E-3<br />

Water Solubility (g/m3): 1<br />

log Pow: 4.68<br />

Unit world Modelling Data<br />

Volumes (m3) Organic C (g/g) Density (kg/m³)<br />

air: 1E+14 1.206<br />

water: 2E+11 1000<br />

soil: 9E+09 0.02 2400<br />

sediment: 1E+08 0.04 2400<br />

susp. sediment: 1E+06 0.2 1500<br />

biota (fish): 2E+05 1000<br />

Result : Calculated distribution between environmental compartments:<br />

air 0.8 %<br />

water 2.2 %<br />

soil 94.7 %<br />

sediment 2.1 %<br />

susp. sediment 0.1 %<br />

biota (fish) < 0.1 %<br />

Reliability : (2) valid with restrictions<br />

Accepted calculation method<br />

Flag : Critical study for SIDS endpoint<br />

04.11.2004 (31)<br />

Media : water – air<br />

Method : other (calculation)<br />

Year : 2003<br />

Method : Calculation according to Thomas (1990) from vapour pressure and water<br />

solubility:<br />

water solubility 1 mg/l = 0.003724 mol m-3<br />

vapour pressure 6.85E-3 Pa [Bayer AG (1994) Berechnung des<br />

Dampfdruckes bei 25 °C für 6PPD (unpublished report)]<br />

Result : Calculated from calculated vapour pressure and measured water solubility:<br />

Henry law constant: 1.84 Pa m3 mol-1 at 25 °C<br />

Reliability : (2) valid with restrictions<br />

Accepted calculation method<br />

Flag : Critical study for SIDS endpoint<br />

04.11.2004 (41)<br />

Media : water – air<br />

Method : other (calculation): HENRYWIN (v3.10)<br />

Year : 2004<br />

Method : HENRYWIN (v3.10)<br />

Bond estimation method (comment) value<br />

9 Hydrogen (Hydrogen to carbon (aromatic) bonds) -1.3886<br />

UNEP PUBLICATIONS 65

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