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EC number: 812-038-2 | CAS number: 1192651-80-1
Water solubility
Administrative data
- Endpoint:
- water solubility
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Study period:
- From 21 January 2016 to 17 February 2016
- Reliability:
- 1 (reliable without restriction)
- Rationale for reliability incl. deficiencies:
- guideline study
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 016
- Report date:
- 2016
Materials and methods
Test guideline
- Qualifier:
- according to guideline
- Guideline:
- EU Method A.6 (Water Solubility)
- Version / remarks:
- (EC 440/2008)
- GLP compliance:
- yes (incl. QA statement)
- Type of method:
- flask method
Test material
- Reference substance name:
- N,N,N-tributylbutan-1-aminium ({[(2S,5R)-2-carbamoyl-7-oxo-1,6-diazabicyclo[3.2.1]oct-6-yl]oxy}sulfonyl)oxidanide
- EC Number:
- 812-038-2
- Cas Number:
- 1192651-80-1
- Molecular formula:
- C23 H46 N4 O6 S
- IUPAC Name:
- N,N,N-tributylbutan-1-aminium ({[(2S,5R)-2-carbamoyl-7-oxo-1,6-diazabicyclo[3.2.1]oct-6-yl]oxy}sulfonyl)oxidanide
- Test material form:
- solid
- Details on test material:
- - Name of test material (as cited in study report): SAM-3
- Lot/batch No.: SAM-3/660-137/K1
- Material number: P60689-51
- Storage conditions: ambient temperature, dry, well ventilated area protected from sunlight.
Constituent 1
- Specific details on test material used for the study:
- Substance was tested as received.
Results and discussion
Water solubility
- Key result
- Water solubility:
- 351.2 g/L
- Temp.:
- 20 °C
- pH:
- >= 6.5 - <= 6.7
- Remarks on result:
- other: The study was performed at ambient temperature (not further specified).
Any other information on results incl. tables
Flask 1: 350.982 g/L
Flask 2: 352.809 g/L
Flask 3: 349.851 g/L
Because the maximum difference meets the criterion of ≤ 15%, the mean of the three concentrations was reported as the water solubility of the substance.
Applicant's summary and conclusion
- Conclusions:
- Using the flask method, the water solubility of the substance at ambient temperature has been determined as 351 g/L. The study was in accordance with EC A.6 and in compliance with GLP.
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