Registration Dossier

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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Administrative data

Endpoint:
long-term toxicity to fish
Type of information:
(Q)SAR
Adequacy of study:
supporting study
Study period:
2014
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
other: A QSAR model, ECOSAR was used to estimate long-term toxicity to fish.
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
other company data
Title:
Unnamed
Year:
2014
Report date:
2014

Materials and methods

Test guideline
Qualifier:
no guideline required
Principles of method if other than guideline:
The QSAR model, Ecological Structure Activity Relationships (ECOSAR) Class Program was used to estimate the long-term toxicity to fish.

Test material

Constituent 1
Reference substance name:
2-methyl decanoic acid
IUPAC Name:
2-methyl decanoic acid
Details on test material:
SMILES notation used: O=C(O)C(CCCCCCCC)C

Test organisms

Test organisms (species):
other: fish

Study design

Water media type:
freshwater

Results and discussion

Effect concentrations
Duration:
30 d
Dose descriptor:
other: chronic value (geometric mean of NOEC and LOEC)
Effect conc.:
1.273 mg/L
Details on results:
As per REACH Guidance Ch 10, a NOEC can be calculated from the chronic value. Therefore, the calculated NOEC = 1.273 mg/L and will be used in the assessment.

Applicant's summary and conclusion

Conclusions:
Using a reliable QSAR model, Ecological Structure Activity Relationships (ECOSAR) Class Program was used to estimate the 30d ChV for fish to be 1.273 mg/L.
Executive summary:

A reliable QSAR model (Ecological Structure-Activity Relationship (ECOSAR) version 1.11) was used to predict the chronic aquatic toxicity of the component 2 -methyl decanoic acid to fish. The 30 day chronic value (the geometric mean of the NOEC and LOEC) was 1.273 mg/L.