Registration Dossier
Registration Dossier
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EC number: 930-936-3 | CAS number: -
Distribution modelling
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: The reliability rating is 2 because the data are calculated
Data source
Reference
- Reference Type:
- other: Computer model
- Title:
- Unnamed
- Year:
- 2 000
- Report date:
- 2009
Materials and methods
- Model:
- other: EPI Suite Level III fugacity model
- Calculation programme:
- Level III fugacity model
- Release year:
- 2 000
- Media:
- air - biota - sediment(s) - soil - water
Test material
- Reference substance name:
- Mono-, and di-(sec-hexadecyl)naphthalene
- EC Number:
- 930-936-3
- Molecular formula:
- C26H40 + C42H72
- IUPAC Name:
- Mono-, and di-(sec-hexadecyl)naphthalene
- Details on test material:
- SMILES notation used: CC(c1ccc2ccccc2c1)CCCCCCCCCCCCCC or CC(CCCCCCCCCCCCCC)C2=CC1=C(C=C2)C=CC=C1
These represent SMILES for sec-hexadecylnaphthalene (94247-63-9), major component in mono-, and di-(sec-hexadecyl)naphthalene.
Constituent 1
Results and discussion
Percent distribution in media
- Air (%):
- 0.05
- Water (%):
- 1.88
- Soil (%):
- 29
- Sediment (%):
- 69.1
- Susp. sediment (%):
- 0
- Biota (%):
- 0
- Aerosol (%):
- 0
Applicant's summary and conclusion
- Conclusions:
- The EPI Suite Level III fugacity model estimates that the study substance will partition largely into the sediment compartment (69%), followed by the soil compartment (29%), water compartment (1.9%) and air (0.05%), based on the calculated values from EPI Suite and SMILES input.
Level III fugacity model estimates that the study substance will partition largely mainly into the sediment and soil compartments with very little into water and the least into air. - Executive summary:
The EPA EpiSuite Level III fugacity model estimates that the study substance will partition largely mainly into the sediment and soil compartments with very little into water and the least into air.
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
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