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Diss Factsheets
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EC number: 201-052-9 | CAS number: 77-73-6
- 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
Long-term toxicity to aquatic invertebrates
Administrative data
Link to relevant study record(s)
- Endpoint:
- long-term toxicity to aquatic invertebrates
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Study period:
- up to 2009
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- other: QSAR calculation, acceptable with restrictions
- Justification for type of information:
- QSAR prediction
- Principles of method if other than guideline:
- The ECOSAR class program has been developed primarily for the evaluation of neutral organic compounds and organic classes with excess toxicity. The QSARs in the ECOSAR program are developed for chemical classes based on measured test data that have been submitted by industry or they are developed by other sources for chemicals with similar structures. Using the measured aquatic toxicity values and estimated Kow values, regression equations can be developed for a class of chemicals. Toxicity values for new chemicals may then be calculated by inserting the Kow into the regression equation and correcting the resultant value for the molecular weight of the compound.
- GLP compliance:
- no
- Remarks:
- QSAR
- Specific details on test material used for the study:
- N/A
- Analytical monitoring:
- not required
- Remarks:
- QSAR
- Details on sampling:
- N/A
- Vehicle:
- no
- Remarks:
- QSAR
- Details on test solutions:
- N/A
- Test organisms (species):
- Daphnia sp.
- Details on test organisms:
- N/A
- Test type:
- other: QSAR
- Water media type:
- other: QSAR
- Limit test:
- no
- Remarks on exposure duration:
- N/A
- Post exposure observation period:
- N/A
- Hardness:
- N/A
- Test temperature:
- N/A
- pH:
- N/A
- Dissolved oxygen:
- N/A
- Salinity:
- N/A
- Conductivity:
- N/A
- Nominal and measured concentrations:
- N/A
- Details on test conditions:
- N/A
- Reference substance (positive control):
- no
- Remarks:
- QSAR
- Key result
- Duration:
- 21 d
- Dose descriptor:
- other: ChV
- Effect conc.:
- 0.812 mg/L
- Nominal / measured:
- estimated
- Conc. based on:
- test mat.
- Basis for effect:
- not specified
- Remarks on result:
- other: Standard duration assumed. Based on a log Kow of 3.165
- Key result
- Duration:
- 21 d
- Dose descriptor:
- NOEC
- Effect conc.:
- 0.574 mg/L
- Nominal / measured:
- estimated
- Conc. based on:
- test mat.
- Basis for effect:
- not specified
- Remarks on result:
- other: Calculated from ChV
- Details on results:
- N/A
- Results with reference substance (positive control):
- N/A
- Reported statistics and error estimates:
- N/A
- Validity criteria fulfilled:
- not applicable
- Remarks:
- QSAR
- Conclusions:
- The estimated ChV for Daphnia sp. is 0.812 mg/L, which corresponds to a NOEC of 0.574 mg/L.
- Executive summary:
A QSAR value has been produced for this endpoint which provides an estimate for the long-term toxicity of the substance to aquatic invertebrates. The estimated ChV for Daphnia sp. is 0.812 mg/L, which corresponds to a NOEC of 0.574 mg/L.
The prediction is considered to fall within the model domain.
- Endpoint:
- long-term toxicity to aquatic invertebrates
- Type of information:
- (Q)SAR
- Adequacy of study:
- key study
- Study period:
- up tp 2020
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- results derived from a valid (Q)SAR model and falling into its applicability domain, with adequate and reliable documentation / justification
- Justification for type of information:
- The Target Lipid Model (TLM) is a framework that relates toxicity to the physicochemical properties of a nonpolar organic constituent. It is a well documented and peer reviewed model that is widely used across the petrochemicals industry. This substance fits within the criteria of the model and there are no reservations about the validity of the model runs. It is expected that this data is reliable with restrictions.
- Qualifier:
- no guideline required
- Principles of method if other than guideline:
- The endpoint calculated is the LL50, EL50, and NOELR -
The narcosis target lipid model was developed to predict the toxicity of chemicals to aquatic organisms that act via narcosis. It is based on the hypothesis that target lipid is the site of toxic action within the organism, that octanol is the appropriate surrogate, and that target lipid has the same physical–chemical properties in all organisms.
The approach describes:
• The theory and how to predict the acute toxicity to these organisms;
• Development of an Acute to Chronic ratio [ACR] for only hydrocarbons and for 29 data points. - GLP compliance:
- no
- Remarks:
- QSAR
- Specific details on test material used for the study:
- A logkow of 2.78 was used as input for the prediction
- Analytical monitoring:
- not required
- Remarks:
- QSAR
- Details on sampling:
- N/A
- Vehicle:
- no
- Remarks:
- QSAR
- Details on test solutions:
- N/A
- Test organisms (species):
- Daphnia magna
- Details on test organisms:
- N/A
- Test type:
- other: QSAR
- Water media type:
- other: QSAR
- Limit test:
- no
- Remarks on exposure duration:
- N/A
- Post exposure observation period:
- N/A
- Hardness:
- N/A
- Test temperature:
- N/A
- pH:
- N/A
- Dissolved oxygen:
- N/A
- Salinity:
- N/A
- Conductivity:
- N/A
- Nominal and measured concentrations:
- N/A
- Details on test conditions:
- N/A
- Reference substance (positive control):
- no
- Remarks:
- QSAR
- Key result
- Duration:
- 21 d
- Dose descriptor:
- NOELR
- Effect conc.:
- 2.405 mg/L
- Nominal / measured:
- nominal
- Conc. based on:
- test mat.
- Basis for effect:
- not specified
- Remarks on result:
- other: Result from QSAR
- Details on results:
- N/A
- Results with reference substance (positive control):
- N/A
- Reported statistics and error estimates:
- N/A
- Validity criteria fulfilled:
- not applicable
- Remarks:
- QSAR
- Conclusions:
- The estimated NOELR for this substance is 2.405 mg/L.
- Executive summary:
The long-term aquatic toxicity to this substance was estimated using the Target Lipid Model based on methodologies described by Mcgrath et al. (2004, 2015). The estimated NOELR for this substance is 2.405 mg/L.
The prediction is considered to fall within the model domain.
Referenceopen allclose all
N/A
N/A
Description of key information
There is a MITI (1997) study for which not all the study design details are reported which describes an EC50 and NOEC of 4.0 mg/L and 3.2 mg/L, respectively. However, this result is higher than the short-term EC50 for aquatic invertebrates (0.62 mg/L). As the original study report has not been reviewed, there is insufficient information to determine the reason for this and therefore the study has been considered not to be reliable.
A QSAR estimate has been included to provide additional data for this endpoint. The estimated 21 day ChV is 0.812 mg/L, which is equivalent to a NOEC of 0.574 mg/L. The estimated NOELR values from TLM QSAR is 2.405 mg/L.
Key value for chemical safety assessment
Fresh water invertebrates
Fresh water invertebrates
- Dose descriptor:
- NOEC
- Effect concentration:
- 3.2 mg/L
Additional information
The toxicity data by the Environmental Agency of Japan (1997) has been cited in OECD SIDS but was unavailable for review. The study of chronic toxicity to Daphnia magna from Dicyclopentadiene over 21 days following OECD TG 202 (1984) showed NOEC 3.2 mg/L and LOEC 10 mg/L.
A QSAR estimate has been included to provide additional data for this endpoint. The estimated 21 day ChV is 0.812 mg/L, which is equivalent to a NOEC of 0.574 mg/L. The use of a QSAR model is considered suitable for this endpoint.
The long-term aquatic toxicity to this substance was estimated using the Target Lipid Model based on methodologies described by Mcgrath et al. (2004, 2015). The estimated NOELR for this substance is 2.405 mg/L.
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.