Registration Dossier
Registration Dossier
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EC number: 947-528-6 | CAS number: -
Short-term toxicity to aquatic invertebrates
Administrative data
- Endpoint:
- short-term toxicity to aquatic invertebrates
- Data waiving:
- study scientifically not necessary / other information available
- Justification for data waiving:
- the study does not need to be conducted because the substance is highly insoluble in water, hence indicating that aquatic toxicity is unlikely to occur
Cross-reference
- Reason / purpose for cross-reference:
- reference to other study
Reference
- Endpoint:
- water solubility
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Study period:
- 2012
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: Calculation by WSKOW v1.42
- Justification for type of information:
- QSAR prediction: migrated from IUCLID 5.6
- Qualifier:
- no guideline required
- Principles of method if other than guideline:
- (Q)SAR
- GLP compliance:
- no
- Type of method:
- other: QSAR
- Key result
- Water solubility:
- ca. 2.492 other: 10^{-15} mg/L
- Conc. based on:
- test mat.
- Incubation duration:
- 24 h
- Temp.:
- 25 °C
- pH:
- ca. 7
- Remarks on result:
- other: QSAR
- Conclusions:
- Interpretation of results (migrated information): insoluble (< 0.1 mg/L)
Water Solubility at 25 deg C (mg/L): 2.492e-015
Water Sol: 2.492e-015 mg/L
SMILES : CCCCCCCC[Sn]12(CCCCCCCC)OC(=O[Sn](CCCCCCCC)(CCCCCCCC)(O=C(O1)C(C)(CC)
CCC(C)C)=O2)C(C)(CC)CCC(C)C
CHEM :
MOL FOR: C52 H106 O5 Sn2
MOL WT : 1048.84
---------------------------------- WSKOW v1.42 Results ------------------------
Log Kow (estimated) : 16.14
Log Kow (experimental): not available from database
Log Kow used by Water solubility estimates: 16.14
Equation Used to Make Water Sol estimate:
Log S (mol/L) = 0.796 - 0.854 log Kow - 0.00728 MW + Correction
(used when Melting Point NOT available)
Correction(s): Value
-------------------- -----
No Applicable Correction Factors
Log Water Solubility (in moles/L) : -20.624
Water Solubility at 25 deg C (mg/L): 2.492e-015
Data source
Materials and methods
Results and discussion
Applicant's summary and conclusion
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
Reproduction or further distribution of this information may be subject to copyright protection. Use of the information without obtaining the permission from the owner(s) of the respective information might violate the rights of the owner.
