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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Data source

Reference
Reference Type:
review article or handbook
Title:
EU risk assessment report
Author:
European Chemicals Bureau
Year:
2006
Bibliographic source:
Vol 64

Materials and methods

Model:
calculation according to Mackay, Level I
Release year:
2 003
Media:
air - biota - sediment(s) - soil - water

Test material

Constituent 1
Chemical structure
Reference substance name:
Phenol
EC Number:
203-632-7
EC Name:
Phenol
Cas Number:
108-95-2
Molecular formula:
C6H6O
IUPAC Name:
phenol

Results and discussion

Percent distribution in media

Air (%):
0.8
Water (%):
98.8
Soil (%):
0.2
Sediment (%):
0.2
Other distribution results:
susp. sediment <0.1
Biota <0.1

Any other information on results incl. tables

Input parameters
temperature (°C): 20
molecular weight (g/mol): 94.11
vapor pressure (Pa): 20.0
water solubility (g/m3): 84,000
log Kow: 1.47

volumes of unit world (m3)
air: 6 000 000 000
water: 7 000 000
soil: 45 000
sediment: 21 000
susp. sediment: 35
biota (fish): 7

Applicant's summary and conclusion

Conclusions:
According the the simulation the hydrosphere is the target compartment for phenol in the environment (98.8%).
Executive summary:

The theoretical distribution of phenol in the environment was calculated using the Mackay Level I. According the simulation the hydrosphere is the main target compartment for phenol in the environment (98.8 % in water) and only a very minor amount is distributed into the air (0.8 %).