Registration Dossier

Data platform availability banner - registered substances factsheets

Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Administrative data

Endpoint:
distribution modelling
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method

Data source

Reference
Reference Type:
other: Mackay calculation
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:
Linalyl acetate
EC Number:
204-116-4
EC Name:
Linalyl acetate
Cas Number:
115-95-7
Molecular formula:
C12H20O2
IUPAC Name:
1,5-dimethyl-1-vinylhex-4-en-1-yl acetate

Study design

Test substance input data:
- Molar mass: 196.29 g/mol [1]
- Data temperature: 25 °C
- Water solubility: 30 g/m³ [2]
- Vapour pressure: 100 Pa [3]
- log Pow: 4.39 [1]
- Melting point: 25 °C [2]


[1]: BASF SE (2008). Department of Product Safety, data assessment, unpublished calculation, SRC EPIWIN v3.20, 24 Sep 2008.
[2]: OECD SIDS Initial Assessment Report, SIAM 14, Paris, France, 26-28 March 2002
[3]: GESTIS - Substance database of 'Berufsgenossenschaftlichen Instituts für Arbeitsschutz' (BGIA), 24 Apr 2007

Results and discussion

Percent distribution in media

Air (%):
97.87
Water (%):
0.43
Soil (%):
0.84
Sediment (%):
0.85
Susp. sediment (%):
0.01
Biota (%):
0
Aerosol (%):
0

Applicant's summary and conclusion