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Environmental fate & pathways

Bioaccumulation: aquatic / sediment

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Administrative data

Endpoint:
bioaccumulation: aquatic / sediment
Type of information:
(Q)SAR
Adequacy of study:
supporting study
Study period:
2011
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: Predicted value from (Q)SAR model.
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
secondary source
Title:
(R)-2-{[(3-methyl-4-nitropyridine-2-yl)methyl]sulfinyl}-1H-benzimidazole
Author:
ChemSpider data bank
Year:
2011
Bibliographic source:
http://www.chemspider.com/Chemical-Structure.23349748

Materials and methods

Test guideline
Qualifier:
no guideline available
Principles of method if other than guideline:
Structure-activity relationship assessed in silico ((Q)SAR model).
GLP compliance:
not specified

Test material

Constituent 1
Chemical structure
Reference substance name:
2-[(R)-(3-methyl-4-nitropyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazole
EC Number:
700-683-1
Cas Number:
853950-77-3
Molecular formula:
C14H12N4O3S
IUPAC Name:
2-[(R)-(3-methyl-4-nitropyridin-2-yl)methanesulfinyl]-1H-1,3-benzodiazole

Results and discussion

Any other information on results incl. tables

The predicted BCF value is 4.17 (L/Kg) whole body weight (Log BCF value: 0.620 at pH=5.5).

Applicant's summary and conclusion

Validity criteria fulfilled:
not specified
Conclusions:
The predicted BCF value is 4.17 (L/Kg) whole body weight (Log BCF value: 0.620 at pH=5.5).