Registration Dossier
Registration Dossier
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EC number: 639-469-7 | CAS number: 14907-27-8
Adsorption / desorption
Administrative data
- Endpoint:
- adsorption / desorption
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: see 'Remark'
- Remarks:
- Calculated result with WSKOW (v1.41) program by using EPIWIN Suie 4.0 software package of US EPA.The Estimation Programs Interface (EPI) SuiteTM was developed by the US Environmental Protection Agency's Office of Pollution Prevention and Toxics and Syracuse Research Corporation (SRC). Copyright 2000-2008 United States Environmental Protection Agency for EPI SuiteTM and all component programs. Freely available on EPA´s web page.
- Justification for type of information:
- QSAR prediction: migrated from IUCLID 5.6
Data source
Reference
- Reference Type:
- other: QSAR-method
- Title:
- Unnamed
- Year:
- 2 011
- Report date:
- 2011
Materials and methods
Test guideline
- Qualifier:
- equivalent or similar to guideline
- Guideline:
- other: QSAR-method
- Deviations:
- yes
- Remarks:
- QSAR-method
- Principles of method if other than guideline:
- calculated result with KOCWIN (v2.00) program
- GLP compliance:
- no
- Type of method:
- other: QSAR-method
Test material
- Reference substance name:
- methyl (2R)-2-amino-3-(1H-indol-3-yl)propanoate hydrochloride
- EC Number:
- 639-469-7
- Cas Number:
- 14907-27-8
- Molecular formula:
- C12H15ClN2O2
- IUPAC Name:
- methyl (2R)-2-amino-3-(1H-indol-3-yl)propanoate hydrochloride
Constituent 1
Results and discussion
Adsorption coefficient
- Type:
- log Koc
- Value:
- 1.441
Any other information on results incl. tables
calculated result with KOCWIN (v2.00) program
Applicant's summary and conclusion
- Conclusions:
- result of adsorption/desorption shows Log Koc 1.4406 (calculated result with KOCWIN (v2.00) program)
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