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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Environmental fate & pathways

Distribution modelling

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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: Calculated with scientifically accepted method
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
other: unpublished calculation
Title:
Unnamed
Year:
2008
Report date:
2008

Materials and methods

Model:
calculation according to Mackay, Level I
Calculation programme:
Mackay Level I V 3.00 Model
Release year:
2 004
Media:
air - biota - sediment(s) - soil - water

Test material

Constituent 1
Chemical structure
Reference substance name:
Methyl acrylate
EC Number:
202-500-6
EC Name:
Methyl acrylate
Cas Number:
96-33-3
Molecular formula:
C4H6O2
IUPAC Name:
methyl prop-2-enoate
Details on test material:
- Name of test material (as cited in study report): Methyl acrylate

Study design

Test substance input data:
- Molar mass: 86.09 g/mol [1]
- Data temperature: 20 °C
- Water solubility: 60000 g/m³ [2]
- Vapour pressure: 9000 Pa [3]
- log Pow: 0.739 [4]
- Melting point: -20 °C [5]

Sources:
[1]: BASF SE (2008). Department of Product Safety, data assessment, unpublished calculation, SRC EPIWIN v3.12, 26 Feb 2008.
[2]: American Conference of Governmental Industrial Hygienists: Documentation of the Threshold Limit Values and Biological Exposure Indices, 6th ed., Vol. 2, pp 931-934, Cincinnati, 1992
[3]: BASF AG (1983) Department of Analytics ZAM/P - M 325, Dampfdruck von Methylacrylot. Report No. BRU 83. 68, . 29 Apr 1983
[4]: BASF AG (1988) Department of Analytics, Determination of the octanol-water partition Coefficient, J.Nr. 129304/02, 23 Aug 1988.
[5]: BASF AG (2008) expert judgement.

Results and discussion

Percent distribution in media

Air (%):
81.9
Water (%):
18
Soil (%):
0.01
Sediment (%):
0.01
Susp. sediment (%):
0
Biota (%):
0
Aerosol (%):
0

Applicant's summary and conclusion