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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Environmental fate & pathways

Biodegradation in water: screening tests

Administrative data

Endpoint:
biodegradation in water: screening test, other
Remarks:
calculation
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
results derived from a valid (Q)SAR model and falling into its applicability domain, with limited documentation / justification

Data source

Referenceopen allclose all

Reference Type:
publication
Title:
Comparison of two methods for obtaining degradation half-lives
Author:
Gouin T, Cousins I, Mackay D.
Year:
2004
Bibliographic source:
Chemosphere. 2004 Aug;56(6):531–5.
Report date:
2004
Reference Type:
other company data
Title:
Unnamed
Year:
2018
Report date:
2018

Materials and methods

Test guideline
Guideline:
other: QSAR

Test material

Constituent 1
Chemical structure
Reference substance name:
Sodium 3-diazo-3,4-dihydro-4-oxonaphthalene-1-sulphonate
EC Number:
264-719-3
EC Name:
Sodium 3-diazo-3,4-dihydro-4-oxonaphthalene-1-sulphonate
Cas Number:
64173-96-2
Molecular formula:
C10H6N2O4S.Na
IUPAC Name:
sodium 3-diazo-3,4-dihydro-4-oxonaphthalene-1-sulphonate
Test material form:
solid
Specific details on test material used for the study:
chemical structure was used as input

Results and discussion

% Degradation
Key result
Parameter:
half-life in days (QSAR/QSPR)
Value:
> 28
Sampling time:
28 d
Remarks on result:
not readily biodegradable based on QSAR/QSPR prediction
Details on results:
CAS Number:
SMILES : O([Na])S(=O)(=O)C1=CC(=N#N)C(=O)c2ccccc12
CHEM :
MOL FOR: C10 H5 N2 O4 S1 Na1
MOL WT : 272.21
--------------------------------- Biowin Summary ----------------------------------------------

Probability of Rapid Biodegradation (BIOWIN v4.10):
Biowin1 (Linear Model) : 0.7436
Biowin2 (Non-Linear Model) : 0.9971
Expert Survey Biodegradation Results:
Biowin3 (Ultimate Survey Model): 2.8163 (weeks )
Biowin4 (Primary Survey Model) : 3.6416 (days-weeks )
MITI Biodegradation Probability:
Biowin5 (MITI Linear Model) : 0.1152
Biowin6 (MITI Non-Linear Model): 0.0431
Anaerobic Biodegradation Probability:
Biowin7 (Anaerobic Linear Model): -0.4488
Ready Biodegradability Prediction: NO

Applicant's summary and conclusion

Interpretation of results:
not readily biodegradable