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Diss Factsheets

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: Scientifically acceptable method

Data source

Reference
Reference Type:
other: Mackay, Level I v3.00.
Title:
Unnamed
Year:
2008
Report date:
2008

Materials and methods

Model:
calculation according to Mackay, Level I
Calculation programme:
v3.00
Release year:
2 004
Media:
air - biota - sediment(s) - soil - water

Test material

Constituent 1
Chemical structure
Reference substance name:
Geraniol
EC Number:
203-377-1
EC Name:
Geraniol
Cas Number:
106-24-1
Molecular formula:
C10H18O
IUPAC Name:
3,7-dimethylocta-2,6-dien-1-ol
Details on test material:
- Name of test material (as cited in study report): Geraniol
Chemical name: trans-3,7-Dimethyl-2,6-octadien-1-ol

Study design

Test substance input data:
- Molar mass: 154.25 g/mol [1]
- Data temperature: 25 °C
- Water solubility: 100 g/m³ [2]
- Vapour pressure: 4 Pa [3]
- log Pow: 3.56 [3]
- Melting point: -15 °C [4]

Sources:
[1]: BASF SE (2008). Department of Product Safety, data assessment, unpublished calculation, SRC EPIWIN v3.20, 26 Feb 2008.
[2]: Chem Inspect Test Inst; Biodegradation and Bioaccumulation Data of Existing Chemicals Based on the CSCL Japan; Published by Japan Chemical Industry Ecology-Toxicology & Information Center. ISBN 4-89074-101-1 (1992) . cited in HSDB 21 Sep 2006
[3]: SRC Database
[4]: Lide, D.R. CRC Handbook of Chemistry and Physics 86TH Edition 2005-2006. CRC Press, Taylor & Francis, Boca Raton, FL 2005, p. 3-266. cited in HSDB 21 Sep 2006

Results and discussion

Percent distribution in media

Air (%):
57.46
Water (%):
26.93
Soil (%):
7.73
Sediment (%):
7.82
Susp. sediment (%):
0.05
Biota (%):
0
Aerosol (%):
0

Applicant's summary and conclusion