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EC number: 267-021-7 | CAS number: 67762-52-1
- 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
Toxicity to microorganisms
Administrative data
Link to relevant study record(s)
- Endpoint:
- activated sludge respiration inhibition testing
- Type of information:
- migrated information: read-across from supporting substance (structural analogue or surrogate)
- Adequacy of study:
- key study
- Study period:
- 11 Feb 1999
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: Guideline study with acceptable restrictions (no analytical purity given).
- Qualifier:
- according to guideline
- Guideline:
- OECD Guideline 209 (Activated Sludge, Respiration Inhibition Test
- Deviations:
- no
- Qualifier:
- according to guideline
- Guideline:
- EPA OPPTS 850.6800 (Modified Activated Sludge, Respiration Inhibition Test for Sparingly Soluble Chemicals)
- Qualifier:
- according to guideline
- Guideline:
- other: EEC Commission Directive 87/302/EEC
- GLP compliance:
- yes (incl. QA statement)
- Remarks:
- The Department of Health of the Government of the United Kingdom (date of inspection 23 Mar 1998)
- Analytical monitoring:
- no
- Vehicle:
- no
- Details on test solutions:
- PREPARATION AND APPLICATION OF TEST SOLUTION
- Method: Test material was prepared by direct dispersion in water. An amount of test material (500 mg) was dispersed in approx. 250 mL of water and subjected to ultrasonication for approx. 30 min. Synthetic sewage (16 mL), activated sewage sludge (200 mL) and water were added to a final volume of 500 mL to give the test concentration of 1000 mg/L. Synthetic sewage was prepared according to the OECD guideline.
- Differential loading: yes
- Controls: The control group was maintained under identical conditions but not exposed to the test material. - Test organisms (species):
- activated sludge of a predominantly domestic sewage
- Details on inoculum:
- - Source of inoculum: Activated sludge was obtained from the aeration stage of the Severn Trent Water Plc sewage treatment plant at Belper, Derbyshire (UK), which predominantely treats domestic sewage.
- Method of cultivation: The sample was maintained on continuous aeration in the laboratory at a temperature of 21 °C and was used on the day of collection. The pH of the sample was 7.5 and the suspended solids equal to 3.9 g/L prior to use. - Test type:
- static
- Water media type:
- freshwater
- Limit test:
- yes
- Total exposure duration:
- 3 h
- Test temperature:
- 21 °C
- Nominal and measured concentrations:
- Nominal: 1000 mg/L
- Details on test conditions:
- TEST SYSTEM
- Test vessel: 500 mL conical flasks
- No. of vessels per concentration: 3
- No. of vessels per control: 2
TEST MEDIUM / WATER PARAMETERS
- Source/preparation of dilution water: laboratory tap water dechlorinated by passage through an activated carbon filter with a total hardness of approx. 100 mg/L as CaCO3.
EFFECT PARAMETERS MEASURED: The respiration rate was recorded after 30 min and 3 h test period.
TEST CONCENTRATIONS
- Range finding study
- Test concentrations: 100 and 1000 mg/L
- Results used to determine the conditions for the definitive study: No significant effect on respiration was observed at all test concentrations employed. - Reference substance (positive control):
- yes
- Remarks:
- 3,5-dichlorophenol
- Duration:
- 30 min
- Dose descriptor:
- EC50
- Effect conc.:
- > 1 000 mg/L
- Nominal / measured:
- nominal
- Conc. based on:
- test mat.
- Basis for effect:
- inhibition of total respiration
- Remarks:
- respiration rate
- Duration:
- 3 h
- Dose descriptor:
- EC50
- Effect conc.:
- > 1 000 mg/L
- Nominal / measured:
- nominal
- Conc. based on:
- test mat.
- Basis for effect:
- inhibition of total respiration
- Remarks:
- respiration rate
- Duration:
- 3 h
- Dose descriptor:
- NOEC
- Effect conc.:
- >= 1 000 mg/L
- Nominal / measured:
- nominal
- Conc. based on:
- test mat.
- Basis for effect:
- inhibition of total respiration
- Remarks:
- respiration rate
- Details on results:
- - Effect concentrations exceeding solubility of substance in test medium: The effect concentration exceeded the water solubility of the test substance.
- Results with reference substance (positive control):
- - Results with reference substance valid? yes
- Relevant effect levels: EC50 (30 min): 12 mg/L, EC50 (3 h): 11 mg/L - Endpoint:
- toxicity to microorganisms
- Type of information:
- migrated information: read-across from supporting substance (structural analogue or surrogate)
- Adequacy of study:
- key study
- Study period:
- 6 Jan 1993
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: GLP study comparable to accepted guideline
- Qualifier:
- equivalent or similar to guideline
- Guideline:
- other: ISO 10712 (Water quality - Pseudomonas putida growth inhibition test)
- Deviations:
- yes
- Remarks:
- the test period is 6 h instead of 16 h
- Principles of method if other than guideline:
- The method is originally described by Bringman and Kuehn which has been modified by Slabbert. This procedure measures the degree of inhibition of growth of a pure culture of Pseudomonas putida during a 6 h period when the cells are in the logarithmic growth phase.
Bringman, G. and Kuehn, R. (1980): Comparison of the toxicity thresholds of water pollutants to bacteria, algae and protozoa in the cell multiplication inhibition test. Water Research 14, 231 – 241.
Slabbert, J.L. (1986): Improved bacterial growth test for rapid water toxicity screening. Bull. Environ. Contam. Toxicol. 37, 565 – 569. - GLP compliance:
- yes
- Analytical monitoring:
- no
- Vehicle:
- no
- Details on test solutions:
- PREPARATION AND APPLICATION OF TEST SOLUTION
- Method: A 50 mg/L stock solution was prepared in water by weighing 0.0196 g of test substance onto a glass slip which was then added to 392 mL of sterile growth medium and stirred overnight. After allowing the stirred solution to settle, 49 mL were removed from below the surface of the undissolved material and transferred, aseptically to each of the flasks (Water-Accommodated Fraction).
- Eluate: no
- Differential loading: no
- Controls: yes / containing inoculated growth medium - Test organisms (species):
- Pseudomonas putida
- Details on inoculum:
- - Laboratory culture: Pseudomonas putida (strain NCIMB9494) was obtained as a freeze-dried culture from National Collections of Industrial and Marine Bacteria Ltd, Aberdeen, UK and stored at 4 °C until use.
- Method of cultivation: The freeze-dried culture was rehydrated in 0.5 mL of nutrient broth (Oxoid Ltd). A loop of this suspension was streaked onto a nutrient agar (Oxoid Ltd) slope in a universal bottle. This was incubated at 25 °C for 24 h and then stored at laboratory temperature, until use as the stock culture.
- Preparation of inoculum for exposure: 18 – 20 h before the start of the test, 4 mL of test medium concentrate was added to 46 mL of deionised water in a sterile conical flask. A loop of Pseudomonas putida stock culture was added to this growth medium solution, and the incubated overnight at 25 °C on an orbital shaker (150 rpm). After this period the cells were diluted by addition of fresh growth medium solution at 25 °C to an optical density which gave an absorbance of 0.85 ± 0.05 at 600 nm. - Test type:
- static
- Water media type:
- freshwater
- Limit test:
- yes
- Total exposure duration:
- 6 h
- Test temperature:
- 25 ± 0.5 °C
- Nominal and measured concentrations:
- Nominal: 50 mg/L
- Details on test conditions:
- TEST SYSTEM
- Test vessel: conical flasks
- Fill volume: 50 mL
- Aeration: constantly shaken at 150 rpm on an incubator shaker
- No. of vessels per concentration: 3
- No. of vessels per control: 3
TEST MEDIUM / WATER PARAMETERS
- Source/preparation of dilution water: deionised water
- Culture medium different from test medium: no / Preparation: 26.25 g dipotassium hydrogen phosphate, 11.25 g potassium dihydrogen phosphate, 1.175 g trisodium citrate dehydrate, 2.5 g ammonium sulphate and 0.25 g magnesium sulphate heptahydrate were dissolved in 1 L of deionised water and autoclaved at 121 °C for 15 min, and then stored at 4 °C. The glucose solution was prepared containing 6.25 g of glucose dissolved in 1 L deionised water. This solution was autoclaved at 121 °C for 15 min, and then stored at 4 °C. Prior to use, equal volumes of each solution were mixed together in a sterile flask.
EFFECT PARAMETERS MEASURED: Growth inhibition was recorded after 6 h of incubation.
TEST CONCENTRATIONS
- Spacing factor for test concentrations: limit test - Reference substance (positive control):
- yes
- Remarks:
- 3,5 dichlorophenol at 18 mg/L
- Duration:
- 6 h
- Dose descriptor:
- other: EL10
- Effect conc.:
- > 50 mg/L
- Nominal / measured:
- nominal
- Conc. based on:
- test mat.
- Remarks:
- (WAF)
- Basis for effect:
- growth inhibition
- Duration:
- 6 h
- Dose descriptor:
- other: EL50
- Effect conc.:
- > 50 mg/L
- Nominal / measured:
- nominal
- Conc. based on:
- test mat.
- Remarks:
- (WAF)
- Basis for effect:
- growth inhibition
- Results with reference substance (positive control):
- - Relevant effect levels: 95% inhibition at a nominal concentration of 18 mg/L after 6 h
Referenceopen allclose all
The study resulted in no effects on the respiration rate of an activated sludge microorganism population (EC50 (3 h): > 1000 mg/L; NOEC ≥ 1000 mg/L).
Table 1: Oxygen consumption rates and percentage inhibition values in the definitive study after 3 h contact time
(- : increase in respiration rate as compared to controls)
Nominal concentration [mg/L] |
Initial O2 reading [mg O2/L] |
Measurement period [min] |
Final O2 reading [mg O2/L] |
O2 Consumption rates [mg O2/L/min] |
% Inhibition |
Control R1 R2 |
6.3 |
9 |
0.7 |
0.62 |
- |
7.2 |
10 |
2.0 |
0.52 |
- |
|
Test substance 1000 R1 1000 R2 1000 R3 |
6.5 |
9 |
1.3 |
0.58 |
-2 |
6.9 |
9 |
1.8 |
0.57 |
0 |
|
6.7 |
10 |
1.4 |
0.53 |
7 |
|
3,5-dichlorophenol 3.2 10 32 |
6.1 |
8 |
1.9 |
0.53 |
7 |
7.4 |
10 |
4.6 |
0.28 |
51 |
|
8.1 |
10 |
7.1 |
0.10 |
82 |
Table 1: Optical density and inhibition results
Flask number |
Nominal concentration |
Mean of optical density at 600 nm |
Corrected value for uninoculated solution |
% inhibition |
1-3 |
Control |
0.368 |
0.366 |
0 |
4-6 |
Reference substance 18 mg/L |
0.020 |
0.018 |
95 |
10-12 |
50 mg/L test substance |
0.514 |
0.511 |
0 |
13 |
blank |
0.002 |
- |
- |
15 |
50 mg/L test substance without inoculum |
0.003 |
- |
- |
Description of key information
EC50 (3 h) > 1000 mg/L (OECD 209, activated sludge )
Key value for chemical safety assessment
- EC50 for microorganisms:
- 1 000 mg/L
Additional information
In accordance to Regulation (EC) No 1907/2006 Annex XI, 1.5 a read across to the structurally similar analogue substance dipentaerythritol with fatty acids, C5 and C9iso (CAS 647028-25-9) and isononanoic acid, mixed esters with dipentaerythritol, heptanoic acid and pentaerythritol (CAS 84418-63-3) was conducted to fulfill the data requirements according to Annex VII-IX ofcarboxylic acids, C5 -9, hexaesters with dipentaerythritol (CAS 67762-52-1) in regard to toxicity to microorganism. This read-across is justified in detail in the overall summary (IUCLID section 6.1) and within the analogue justification in IUCLID section 13. The read-across substances consist of the same alcohol component (dipentaerythritol) and similar fatty acid chain lengths as the target substance (C5-9 for the target substance compared to C9iso and C5,9iso for the source substances, respectively).
The first study investigated the toxicity of dipentaerythritol with fatty acids, C5 and C9iso to microorganisms. The test was performed according to OECD 209 (Mead, 1999) with activated sludge of a predominately domestic sewage treatment plant under GLP conditions. Mircoorganisms were exposed to a limit test concentration of 1000 mg/L for 3 h. No effects on the respiration rate of activated sludge microorganisms population were observed. Therefore, this study resulted in an EC50 (3 h) of > 1000 mg/L and a NOEC (3 h) of ≥ 1000 mg/L was derived.
An additional study investigated the toxicity of isononanoic acid, mixed esters with dipentaerythritol, heptanoic acid and pentaerythritol to aquatic microorganisms. The GLP study was conducted similarly to ISO 10712 investigating the growth of Pseudomonas putida (Comber, 1993). A Water Accommodated Fraction (WAF) of nominal 50 mg/L was used for the test. No inhibitory effect was observed after 6 h. Hence the EL10 was determined to be > 50 mg/L (nominal) based on growth inhibition.
Based on the results from the substance itself and from a structurally related read-across substance (in accordance to Regulation (EC) No 1907/2006 Annex XI, 1.5), characterized by a similar ecotoxicological profile and structure, it can be concluded thatcarboxylic acids, C5 -9, hexaesters with dipentaerythritolwill not exhibit microbial inhibition to aquatic microorganisms up to the limit of water solubility.
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.
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