Registration Dossier

Diss Factsheets

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: Reliability assigned to QSAR
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
other: QSAR calculation
Title:
No information

Materials and methods

Model:
calculation according to Mackay, Level I
Calculation programme:
Mackay Level 1 v3.00
Media:
air - biota - sediment(s) - soil - water

Test material

Constituent 1
Chemical structure
Reference substance name:
O-acetylsalicylic acid
EC Number:
200-064-1
EC Name:
O-acetylsalicylic acid
Cas Number:
50-78-2
Molecular formula:
C9H8O4
IUPAC Name:
2-acetoxybenzoic acid

Study design

Test substance input data:
Input (at 25°C):
MW : 180.16 MP : 136
VP: 0.0034 Pa
WS : 4600 mg/L Log Kow: 1.19

Results and discussion

Percent distribution in media

Air (%):
0.39
Water (%):
98.23
Soil (%):
1.35

Applicant's summary and conclusion

Conclusions:
The environmental target compartment is water (98 % of substance).
Soil/sediment compartments are predicted not to be of concern (1.35 %)