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Environmental fate & pathways

Distribution modelling

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Administrative data

Endpoint:
distribution modelling
Type of information:
calculation (if not (Q)SAR)
Remarks:
Migrated phrase: estimated by calculation
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Accepted calculation method

Data source

Reference
Reference Type:
other: Mackay Level I calculation
Title:
Unnamed
Year:
2013

Materials and methods

Model:
calculation according to Mackay, Level I
Calculation programme:
Level I Version 3.0
Release year:
2 004
Media:
air - biota - sediment(s) - soil - water

Test material

Reference
Name:
Unnamed
Type:
Constituent

Study design

Test substance input data:
CHEMICAL PARAMETERS
Chemical Type 1
Molar Mass 737 g/mol
Data Temperature 25 °C 298,15 K
Water Solubility 7,37E-03 g/m³ 1,00E-05 mol/m³
Vapour Pressure 1,29E-13 Pa
The Vapour Pressure required is that of the chemical in the state at the data temperature.
For solids, the cooled liquid vapour pressure is also calculated.
Melting Point 292 °C 565,15 K
Fugacity Ratio 2,29E-03
Sub-cooled Liquid Vapour Pressure 5,64E-11 Pa
Henry's Law Constant 1,29E-08 Pa.m³/mol
Log Kow 12,0
Environmental properties:
ENVIRONMENTAL PARAMETERS
Volume Density Organic Carbon Fish Lipid
m³ kg/m³ g/g g/g
Air 1,00E+14 1,19 -
Aerosol 2000 2000 -
Water 2,00E+11 1000 -
Suspended Particles 1,00E+06 1500 0,200
Fish 2,00E+05 1000 - 0,0500
Soil 9,00E+09 2400 0,0200
Sediment 1,00E+08 2400 0,0400

Results and discussion

Percent distribution in media

Air (%):
0
Water (%):
0
Soil (%):
97.8
Sediment (%):
2.17
Susp. sediment (%):
0.068
Biota (%):
0.006
Aerosol (%):
0

Applicant's summary and conclusion