Ethanol, 2,2'-iminobis-, N-(C13-15-branched and linear alkyl) derivs.

Distribution modelling

Administrative data

Endpoint:

distribution modelling

Type of information:

(Q)SAR

Adequacy of study:

key study

Reliability:

2 (reliable with restrictions)

Rationale for reliability incl. deficiencies:

other: Scientifically acceptable calculation

Data source

Reference

Reference Type:

other: Level I Mackay Modelling

Title:

Unnamed

Year:

2010

Materials and methods

Model:

calculation according to Mackay, Level I

Calculation programme:

Level 1 - Fugacity-Based Environmental Equilibrium Partitioning Model (Trent University (2004), v3.00)

Release year:

2 004

Media:

air - biota - sediment(s) - soil - water

Test material

Test material information

Constituent 1

Reference substance name:

Ethanol, 2,2'-iminobis-, N-(C13-15-branched and linear alkyl) derivs.

EC Number:

308-208-6

EC Name:

Ethanol, 2,2'-iminobis-, N-(C13-15-branched and linear alkyl) derivs.

Cas Number:

97925-95-6

Molecular formula:

Not applicable - multiconstituent substance

IUPAC Name:

Ethanol, 2,2'-iminobis-, N-(C13-15-branched and linear alkyl) derivs.

Study design

Test substance input data:

- Molar mass: 301 g/mol
- Data temperature: 25 °C
- Water solubility: 80.8 mg/L
- Vapour pressure: 0.031 Pa
- log Pow: 4.88
- Pour point: 3 °C

Results and discussion

Percent distribution in media

Air (%):

0.031

Water (%):

7.63

Soil (%):

45.8

Sediment (%):

46.3

Susp. sediment (%):

0.297

Biota (%):

0.029

Aerosol (%):

0.001

Any other information on results incl. tables

Table 2: Distribution of Atmer 163 in the environment

Compartment	Z Value [mol/m³ Pa]	VZ [mol/pa]	Concentration [mol/m³]	Amount [%]
Air	4.03E-04	2.42E+06	1.70E-08	0.0308
Aerosol	7.81E+05	93697	33.0	1.19E-03
Water	85.7	6.00E+08	3.62E-03	7.63
Suspended particles	6.68E+05	2.34E+07	28.2	0.297
Fish	3.25E+05	2.28E+06	13.7	0.0289
Soil	79996	3.60E+09	3.38	45.8
Sediment	1.73E+05	3.64E+09	7.32	46.3
Total		7.87E+09		100.00