Registration Dossier
Registration Dossier
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EC number: 203-446-6 | CAS number: 106-95-6
Distribution modelling
Administrative data
- Endpoint:
- distribution modelling
- Type of information:
- calculation (if not (Q)SAR)
- Remarks:
- Migrated phrase: estimated by calculation
- Adequacy of study:
- supporting study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: see 'Remark'
- Remarks:
- Individual estimation programs and/or their underlying predictive methods and equations have been described in numerous journal articles in peer-reviewed technical journals. In addition, EPI Suite™ has undergone detailed review by a panel of EPA’s independent Science Advisory Board (SAB).
Data source
Reference
- Reference Type:
- other: Simulation software
- Title:
- Unnamed
Materials and methods
- Model:
- calculation according to Mackay, Level III
- Calculation programme:
- EPI Suite v4.11 - Level III fugacity level
- Media:
- other: air - water - soil - sediment
Test material
- Reference substance name:
- 3-bromopropene
- EC Number:
- 203-446-6
- EC Name:
- 3-bromopropene
- Cas Number:
- 106-95-6
- Molecular formula:
- C3H5Br
- IUPAC Name:
- 3-bromoprop-1-ene
- Reference substance name:
- 1-bromoprop-2-ene
- IUPAC Name:
- 1-bromoprop-2-ene
Constituent 1
Constituent 2
Results and discussion
Percent distribution in media
- Air (%):
- 14
- Water (%):
- 74.3
- Soil (%):
- 11.4
- Sediment (%):
- 0.258
Any other information on results incl. tables
Mass Amount Half-Life Emissions
(percent) (hr) (kg/hr)
Air 14 11.8 1000
Water 74.3 360 1000
Soil 11.4 720 1000
Sediment 0.258 3.24e+003 0
Fugacity Reaction Advection Reaction Advection
(atm) (kg/hr) (kg/hr) (percent) (percent)
Air 7.13e-011 2.07e+003 353 69 11.8
Water 8.59e-008 360 187 12 6.24
Soil 1.09e-007 27.6 0 0.919 0
Sediment 7.65e-008 0.139 0.013 0.00463 0.000433
Persistence Time: 84 hr
Reaction Time: 102 hr
Advection Time: 466 hr
Percent Reacted: 82
Percent Advected: 18
Half-Lives (hr), (based upon Biowin (Ultimate) and Aopwin):
Air: 11.82
Water: 360
Soil: 720
Sediment: 3240
Biowin estimate: 2.961 (weeks )
Advection Times (hr):
Air: 100
Water: 1000
Sediment: 5e+004
Applicant's summary and conclusion
- Conclusions:
- The level III fugacity model contained in EPI Suite v4.11 gives the following estimates regarding the distribution and half-time of the test material in the following media :
Mass Amount Half-Life
(percent) (hr)
Air 14 11.8
Water 74.3 360
Soil 11.4 720
Sediment 0.258 3240 - Executive summary:
The level III fugacity model contained in EPI Suite v4.11 gives the following estimates regarding the distribution and half-time of the test material in the following media :
Mass Amount Half-Life
% hr
Air 14 11.8
Water 74.3 360
Soil 11.4 720
Sediment 0.258 3240
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