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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
Reliability:
4 (not assignable)
Rationale for reliability incl. deficiencies:
other: QSAR estimation
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
other: QSAR
Title:
Estimation of BCF
Author:
Bootman Chemical Safety Ltd.
Year:
2009
Bibliographic source:
US EPA. 2009. Estimation Programs Interface Suite™ for Microsoft® Windows, v 4.00. United States Environmental Protection Agency, Washington, DC, USA.

Materials and methods

Test guideline
Qualifier:
no guideline required
GLP compliance:
no

Test material

Constituent 1
Reference substance name:
tertiary butyl acetate
IUPAC Name:
tertiary butyl acetate
Constituent 2
Chemical structure
Reference substance name:
tert-butyl acetate
EC Number:
208-760-7
EC Name:
tert-butyl acetate
Cas Number:
540-88-5
Molecular formula:
C6H12O2
IUPAC Name:
tert-butyl acetate

Test organisms

Test organisms (species):
other: QSAR estimation

Study design

Route of exposure:
other: QSAR
Test type:
other: QSAR

Results and discussion

Bioaccumulation factor
Type:
BCF
Value:
5.61
Remarks on result:
other: QSAR estimation using BCFBAF v3.0 module from EPISuite v4.0

Any other information on results incl. tables

BCF value of 5.61 (Log BCF 0.749) using the BCFBAF v3.0 module of EPISuite v4.0.

Applicant's summary and conclusion

Conclusions:
QSAR estimation suggests a BCF value of 5.61 (Log BCF 0.749) using the BCFBAF v3.0 module of EPISuite v4.0.

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