Registration Dossier
Registration Dossier
Data platform availability banner - registered substances factsheets
Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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
Use of this information is subject to copyright laws and may require the permission of the owner of the information, as described in the ECHA Legal Notice.
EC number: 600-024-7 | CAS number: 1000777-61-6
- Life Cycle description
- Uses advised against
- Endpoint summary
- Appearance / physical state / colour
- Melting point / freezing point
- Boiling point
- Density
- Particle size distribution (Granulometry)
- Vapour pressure
- Partition coefficient
- Water solubility
- Solubility in organic solvents / fat solubility
- Surface tension
- Flash point
- Auto flammability
- Flammability
- Explosiveness
- Oxidising properties
- Oxidation reduction potential
- Stability in organic solvents and identity of relevant degradation products
- Storage stability and reactivity towards container material
- Stability: thermal, sunlight, metals
- pH
- Dissociation constant
- Viscosity
- Additional physico-chemical information
- Additional physico-chemical properties of nanomaterials
- Nanomaterial agglomeration / aggregation
- Nanomaterial crystalline phase
- Nanomaterial crystallite and grain size
- Nanomaterial aspect ratio / shape
- Nanomaterial specific surface area
- Nanomaterial Zeta potential
- Nanomaterial surface chemistry
- Nanomaterial dustiness
- Nanomaterial porosity
- Nanomaterial pour density
- Nanomaterial photocatalytic activity
- Nanomaterial radical formation potential
- Nanomaterial catalytic activity
- Endpoint summary
- Stability
- Biodegradation
- Bioaccumulation
- Transport and distribution
- Environmental data
- Additional information on environmental fate and behaviour
- Ecotoxicological Summary
- Aquatic toxicity
- Endpoint summary
- Short-term toxicity to fish
- Long-term toxicity to fish
- Short-term toxicity to aquatic invertebrates
- Long-term toxicity to aquatic invertebrates
- Toxicity to aquatic algae and cyanobacteria
- Toxicity to aquatic plants other than algae
- Toxicity to microorganisms
- Endocrine disrupter testing in aquatic vertebrates – in vivo
- Toxicity to other aquatic organisms
- Sediment toxicity
- Terrestrial toxicity
- Biological effects monitoring
- Biotransformation and kinetics
- Additional ecotoxological information
- Toxicological Summary
- Toxicokinetics, metabolism and distribution
- Acute Toxicity
- Irritation / corrosion
- Sensitisation
- Repeated dose toxicity
- Genetic toxicity
- Carcinogenicity
- Toxicity to reproduction
- Specific investigations
- Exposure related observations in humans
- Toxic effects on livestock and pets
- Additional toxicological data
Partition coefficient
Administrative data
- Endpoint:
- partition coefficient
- Type of information:
- experimental study
- Adequacy of study:
- key study
- Reliability:
- 1 (reliable without restriction)
- Rationale for reliability incl. deficiencies:
- guideline study
Data source
Reference
- Reference Type:
- study report
- Title:
- Unnamed
- Year:
- 2 013
- Report date:
- 2013
Materials and methods
Test guideline
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 107 (Partition Coefficient (n-octanol / water), Shake Flask Method)
- GLP compliance:
- yes (incl. QA statement)
- Type of method:
- shake-flask method to: flask method
- Partition coefficient type:
- octanol-water
Test material
- Reference substance name:
- bis(N,N,N-trimethyladamantan-1-aminium) sulfate
- EC Number:
- 600-024-7
- Cas Number:
- 1000777-61-6
- Molecular formula:
- C26 H48 N2 O4 S
- IUPAC Name:
- bis(N,N,N-trimethyladamantan-1-aminium) sulfate
- Test material form:
- other: granular
- Details on test material:
- Name of test material (as cited in study report): Tricyclo[3.3.1.13,7]decan-1-aminium, N,N,N,-trimethyl-, sulfate (2:1)
Analytical purity: 83.2 g/100g (by 1H NMR spectrometry; study no 11 L00496)
Lot/batch No.: ADTAS P5310.10.10
Expiration date of the lot/batch: Oct 20, 2011
Constituent 1
Study design
- Analytical method:
- photometric method
Results and discussion
Partition coefficient
- Type:
- log Pow
- Partition coefficient:
- -2.7
- Temp.:
- 23 °C
- pH:
- 3.9
- Details on results:
- log Pow = -2.7 at 23°C and pH = 3.9 (mean of all pH values of the water phases)
Any other information on results incl. tables
Individual Results
Amount of test item determined in the stock solutions
Stock solution |
Concentration of test item Nominal [mg/l] |
Concentration of test item Found [mg/l] |
Recovery [%] |
1 |
4723 |
4661 |
98.7 |
2 |
4640 |
4737 |
102.1 |
log Powcalculation
Test |
tot. conc. [mg/100 ml] |
Vwater [mI] |
Vn-octanol [mI] |
Cfound inwater [mI/l] |
Cfound in n-octanol [mI/l] |
Pow |
log Pow |
1a |
472.30 |
40 |
20 |
2233.0 |
10 |
0.0045 |
-2.35 |
1b |
472.30 |
20 |
20 |
4932.2 |
10 |
0.0020 |
-2.69 |
1c |
472.30 |
20 |
40 |
8762.7 |
10 |
0.0011 |
-2.94 |
2a |
464.00 |
40 |
20 |
2239.0 |
10 |
0.0045 |
-2.35 |
2b |
464.00 |
20 |
20 |
4843.9 |
10 |
0.0021 |
-2.69 |
2c |
464.00 |
20 |
40 |
8674.0 |
10 |
0.0012 |
-2.94 |
|
|
|
|
|
Mean |
0.0026 |
-2.66 |
|
|
|
|
|
SD |
0.0015 |
-0.27 |
Recovery
Test |
mexp [mg] |
mfound water [mg] |
mfound n-octanol [mg] |
mfound total [mg] |
recovery [%] |
pHwater* |
1a |
94.460 |
89.320 |
0.200 |
89.520 |
94.8 |
4.1 |
1b |
94.460 |
98.644 |
0.200 |
98.844 |
104.6 |
3.8 |
1c |
188.920 |
175.254 |
0.400 |
175.654 |
93.0 |
3.5 |
2a |
92.800 |
89.560 |
0.200 |
89.760 |
96.7 |
4.2 |
2b |
92.800 |
96.878 |
0.200 |
97.078 |
104.6 |
3.9 |
2c |
185.600 |
173.480 |
0.400 |
73.880 |
93.7 |
3.6 |
Water used |
6.2 |
* The mean of all pH values of the water phases:pH=3.9.
Remark: All results are calculated with Excel (with not rounded values).
Solubility in n-octanol: Additionally, the solubility of the test item in n-octanol was tested. Mixtures of test item with n-octanol were prepared at different concentrations. After shaking at room temperature (23 oc), the preparations were visually checked:
Amount of test item [mg] |
Octanol added [ml] |
Sample size |
Observation |
94.21 |
10 |
9.4 g/l |
completely dissolved after shaking for 1 hour |
523.21 |
10 |
52.3 g/l |
completely dissolved after shaking for 2 hours |
[g] |
[g] |
|
|
1.03 |
9.15 |
10.1 g/100g |
completely dissolved after rolling overnight |
1.00 |
4.02 |
19.9 g/100g |
completely dissolved after rolling overnight |
0.75 |
1.81 |
29.4 g/100g |
completely dissolved after rolling overnight |
5.00 |
5.01 |
49.9 g/100g |
not dissolved after rolling overnight |
1.03 |
1.56 |
39.8 g/100g |
not dissolved after rolling overnight |
Thus the octanol solubility was estimated to be >29.4 g/100 g and <39.8 g/100g (m test item / m mixture) .
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.