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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Ecotoxicological information

Toxicity to aquatic plants other than algae

Administrative data

Endpoint:
toxicity to aquatic plants other than algae
Type of information:
(Q)SAR
Adequacy of study:
key study
Reliability:
1 (reliable without restriction)
Rationale for reliability incl. deficiencies:
results derived from a valid (Q)SAR model and falling into its applicability domain, with adequate and reliable documentation / justification
Justification for type of information:
Valid QSAR model applied (Epi-Suite v 4.1)

Data source

Reference
Reference Type:
other: QSAR
Title:
Unnamed
Year:
2000
Report date:
2018

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
other: Epi-Suite QSAR calculation
Version / remarks:
4.1
Principles of method if other than guideline:
QSAR calculation (EPI-Suite EPIWIN v 1.4)
Smiles notation applied: CCCCCCCCC=CCCCCCCCC(=O)NC(CO)C(C(CCCCCCCCCCCCCC)O)O

Test material

1
Chemical structure
Reference substance name:
Ceramides
EC Number:
309-560-3
EC Name:
Ceramides
Cas Number:
100403-19-8
Molecular formula:
C36 H71 N1 O4
IUPAC Name:
Ceramides

Test organisms

Test organisms (species):
other: Green algae

Results and discussion

Effect concentrations
Key result
Duration:
96 h
Dose descriptor:
EC50
Effect conc.:
0 mg/L
Nominal / measured:
estimated
Basis for effect:
not specified
Details on results:
Applying the water solubility SW =1.8E-008 mg/L and the octanol-water partitioning coefficient Log Kow = 11.79 (KOWWIN version 1.68 estimate)) the estimated toxicity towards daphnids was calculated.
The calculated toxicity towards algae was above the calcualted water solubility of the test substance.
96-hr, LC50 = 0.000105 mg/L
Results with reference substance (positive control):
Not applicable

Applicant's summary and conclusion

Conclusions:
The calculated toxicity was above the calcualted water solubility of the test substance.
96-hr, LC50 = 0.000105 mg/L
Executive summary:

A QSAR calculation was performed applying EPI-Suite (EPIWIN v. 1.4), smiles notation : CCCCCCCCC=CCCCCCCCC(=O)NC(CO)C(C(CCCCCCCCCCCCCC)O)O and the following input parameters:

SW =1.8E-008 mg/L; Log Kow = 9.33 (KOWWIN version 1.68 estimate)

The calculated toxicity towards algae was above the calcualted water solubility of the test substance.

96-hr, LC50 =  0.000105 mg/L