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Ecotoxicological information

Short-term toxicity to aquatic invertebrates

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Endpoint:
short-term toxicity to aquatic invertebrates
Remarks:
Q)SAR calculated endpoint
Type of information:
(Q)SAR
Adequacy of study:
key study
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:
QSAR prediction: US EPA accepted QSAR method for chemicals properties assessment.
Qualifier:
according to guideline
Guideline:
other: QSAR model
Principles of method if other than guideline:
EPI Suite v 4.0/ECOSARv1.00
GLP compliance:
no
Remarks:
not applicable. QSAR model
Analytical monitoring:
not required
Vehicle:
no
Test organisms (species):
other: Daphnid species
Test type:
other: QSAR model
Water media type:
freshwater
Limit test:
no
Total exposure duration:
48 h
Hardness:
not applicable. QSAR model
Test temperature:
not applicable. QSAR model
pH:
not applicable. QSAR model
Dissolved oxygen:
not applicable. QSAR model
Salinity:
not applicable. QSAR model
Nominal and measured concentrations:
not applicable. QSAR model
Details on test conditions:
SMILES : CCCCCCCCCC
CHEM : Stoddard solvent
CAS Num: 8052-41-3
MOL FOR: C10 H22
MOL WT : 142.29
Log Kow: 5.252 (EPISuite Kowwin v1.68 Estimate)
Log Kow: 5.01 (PhysProp DB exp value - for comparison only)
Melt Pt: -29.70 (deg C, PhysProp DB exp value for Wat Sol est)
Wat Sol: 1.409 (mg/L, EPISuite WSKowwin v1.43 Estimate)
Wat Sol: 0.052 (mg/L, PhysProp DB exp value)
Reference substance (positive control):
not required
Duration:
48 h
Dose descriptor:
LC50
Effect conc.:
0.107 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
other: (Q)SAR prediction
Remarks on result:
other: non-toxic , as determined by (Q)SAR. Chemical may not be soluble enough to measure this predicted effect.
Details on results:
The ECOSAR QSAR model predicts that LC50 for fresh water species Daphnid would to be 0.107 mg/l .This result signifies that the test substance is not expected to be toxic .
This result signifies that the test substance is not expected to be toxic at the limit of solubility. This result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS.
The model indicated that Stoddard solvent possess properties indicating a potential hazard for the environment (acute toxicity for fish, invertebrates, and algae (in the range of 0.1 – 1.0 mg/l) based on nominal loadings.

Overview of QSARs estimations on short-term aquatic toxicity of Stoddard solvent to Daphnid

 

Method

 

Results

Remarks

Reference

QSAR

estimate

Daphnid , 48-hr LC50 =0.107 mg/L (ppm)

 

Daphnid, 30-day, ChV (chronic value) = 0.024 mg/L (ppm)

 

 

Reliable with restrictions,

QSAR estimated data

ECOSAR Program (v1.00)

Using the EPIWIN ECOSAR QSAR model aLC50 for fresh water Daphnid of   0.107 mg/l was established. 

   

Daphnid , 48-hr LC50 =0.107 mg/L (ppm)

Daphnid, 30-day, ChV (chronic value) = 0.024 mg/L (ppm)

Validity criteria fulfilled:
yes
Remarks:
US EPA accepted QSAR method for chemicals properties assessment.
Conclusions:
The ECOSAR QSAR model predicts that LC50 for fresh water species Daphnid would to be 0.107 mg/l .This result signifies that the test substance is not expected to be toxic .
This result signifies that the test substance is not expected to be toxic at the limit of solubility. This result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS.
The model indicated that Stoddard solvent possess properties indicating a potential hazard for the environment (acute toxicity for fish, invertebrates, and algae (in the range of 0.1 – 1.0 mg/l) based on nominal loadings.

Executive summary:

The ECOSAR QSAR model predicts that LC50 for fresh water species Daphnid would to be 0.107 mg/l .This result signifies that the test substance is not expected to be toxic . This result signifies that the test substance is not expected to be toxic at the limit of solubility. This result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS. The model indicated that Stoddard solvent possess properties indicating a potential hazard for the environment (acute toxicity for fish, invertebrates, and algae (in the range of 0.1 – 1.0 mg/l) based on nominal loadings.

Endpoint:
short-term toxicity to aquatic invertebrates
Type of information:
experimental study
Adequacy of study:
key study
Study period:
96 Hours
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
data from handbook or collection of data
Justification for type of information:
Published data in readily available literature as a reliable data source.
Qualifier:
equivalent or similar to guideline
Guideline:
EPA OPPTS 850.1020 (Gammarid Acute Toxicity Test)
Principles of method if other than guideline:
Three different test methods were used in closed or open systems to give a total of five tests (two closed, three open) for the gammarid and three tests (one closed, two open) for the shrimp. The different methodologies for the preparation and extraction of the test medium and different chamber design meant that, in some cases, surface films or droplets of undissolved white spirit components were present. As expected, test methods providing opportunity for evaporation of white spirit and those with lower extraction efficiency for chemical analysis produced 96-h LC50 estimates higher than those for other methods.
GLP compliance:
not specified
Analytical monitoring:
yes
Details on sampling:
100 ml samples of the aqueous exposure phase were sampled for paraffin content.
Vehicle:
yes
Details on test solutions:
The marine invertebrate, Chaetogammarus marinus, was exposed for 96-hours to the test substance to seven nominal loading levels that ranged from 1 to 1000 mg/L .
Test organisms (species):
other: Chaetogammarius marinus
Details on test organisms:
The test organisms were from a laboratory culture, approximately 5mm long. The laboratory culture was maintained under standardized conditions and fed Fucus sp. Housing included shelter for concealment.

Test type:
semi-static
Water media type:
saltwater
Limit test:
no
Total exposure duration:
96 h
Post exposure observation period:
None
Test temperature:
15 degrees C
pH:
7.5 to 8.3
Dissolved oxygen:
Most test solutions were saturated with oxygen, with the exception of a few test solutions that were lower than saturation but >6.5 mg/L
Salinity:
2.8%
Nominal and measured concentrations:
The nominal loading levels were seven nominal loading levels that ranged from 1 to 1000 mg/L, which each measured <0.005 mg/L at test initiation
Details on test conditions:
A test system consisted of 10 organisms placed in 1000 ml of treatment solution contained in a glass beaker and covered with glass to minimize volatile losses. The control and treatment solutions were prepared in duplicate.
Reference substance (positive control):
not specified
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
3.5 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
mortality
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
> 2.5 - < 4.5 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
mortality
Remarks on result:
other: closed systems
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
> 10 - < 40 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
mortality
Remarks on result:
other: open systems
Details on results:
The study resulted in a 96-hour LC50 of 3.5 mg/L, based on nominal loading.
The 96-h LC50 values for closed systems with high efficiency extraction ranged from 2.5 to 4.5 mg/litre, whereas those for open systems ranged from 10 to 40 mg/litre (both based on dosed amounts).
Validity criteria fulfilled:
yes
Conclusions:
The study resulted in a 96-hour LC50 of 3.5 mg/L, based on nominal loading.
The 96-h LC50 values for closed systems with high efficiency extraction ranged from 2.5 to 4.5 mg/litre, whereas those for open systems ranged from 10 to 40 mg/litre (both based on dosed amounts).
Executive summary:

The marine invertebrate, Chaetogammarus marinus, was exposed for 96-hours to the test substance to seven nominal loading levels that ranged from 1 to 1000 mg/L . The study resulted in a 96-hour LC50 of 3.5 mg/L, based on nominal loading.

Endpoint:
short-term toxicity to aquatic invertebrates
Type of information:
experimental study
Adequacy of study:
key study
Study period:
96 Hours
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
data from handbook or collection of data
Justification for type of information:
Published data in readily available literature as a reliable data source.
Qualifier:
equivalent or similar to guideline
Guideline:
EPA OPPTS 850.1020 (Gammarid Acute Toxicity Test)
Principles of method if other than guideline:
Three different test methods were used in closed or open systems to give a total of five tests (two closed, three open) for the gammarid and three tests (one closed, two open) for the shrimp. The different methodologies for the preparation and extraction of the test medium and different chamber design meant that, in some cases, surface films or droplets of undissolved white spirit components were present. As expected, test methods providing opportunity for evaporation of white spirit and those with lower extraction efficiency for chemical analysis produced 96-h LC50 estimates higher than those for other methods.
GLP compliance:
not specified
Analytical monitoring:
yes
Details on sampling:
100 ml samples of the aqueous exposure phase were sampled for paraffin content.
Vehicle:
yes
Details on test solutions:
The marine invertebrate, brown shrimp (Crangon crangon) , was exposed for 96-hours to the test substance
Test organisms (species):
Crangon crangon
Details on test organisms:
The test organisms were from a laboratory cultur. The laboratory culture was maintained under standardized conditions and fed Fucus sp. Housing included shelter for concealment.

Test type:
semi-static
Water media type:
saltwater
Limit test:
no
Total exposure duration:
96 h
Post exposure observation period:
None
Test temperature:
15 degrees C
pH:
7.5 to 8.3
Dissolved oxygen:
Most test solutions were saturated with oxygen, with the exception of a few test solutions that were lower than saturation but >6.5 mg/L
Salinity:
2.8%
Nominal and measured concentrations:
The nominal loading levels were seven nominal loading levels that ranged from 1 to 1000 mg/L, which each measured <0.005 mg/L at test initiation
Details on test conditions:
A test system consisted of 10 organisms placed in 1000 ml of treatment solution contained in a glass beaker and covered with glass to minimize volatile losses. The control and treatment solutions were prepared in duplicate.
Reference substance (positive control):
not specified
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
> 2.5 - < 4.5 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
mortality
Remarks on result:
other: closed systems
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
> 10 - < 40 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
mortality
Remarks on result:
other: open systems
Details on results:
The 96-h LC50 values for closed systems with high efficiency extraction ranged from 2.5 to 4.5 mg/litre, whereas those for open systems ranged from 10 to 40 mg/litre (both based on dosed amounts).
Validity criteria fulfilled:
yes
Conclusions:
The 96-h LC50 values for closed systems with high efficiency extraction ranged from 2.5 to 4.5 mg/litre, whereas those for open systems ranged from 10 to 40 mg/litre (both based on dosed amounts).
Executive summary:

The marine invertebrate, brown shrimp (Crangon crangon) was exposed for 96-hours . The 96-h LC50 values for closed systems with high efficiency extraction ranged from 2.5 to 4.5 mg/litre, whereas those for open systems ranged from 10 to 40 mg/litre (both based on dosed amounts).

Description of key information

The ECOSAR QSAR model predicts that LC50 for fresh water species Daphnid would to be 0.107 mg/l .

The marine invertebrate, Chaetogammarus marinus, was exposed for 96-hours to the test substance to seven nominal loading levels that ranged from 1 to 1000 mg/L . The study resulted in a 96-hour LC50 of 3.5 mg/L, based on nominal loading.

 

The 96-h LC50 values for closed systems with high efficiency extraction ranged from 2.5 to 4.5 mg/litre, whereas those for open systems ranged from 10 to 40 mg/litre (both based on dosed   amounts).

Key value for chemical safety assessment

Fresh water invertebrates

Fresh water invertebrates
Effect concentration:
0.107 mg/L

Marine water invertebrates

Marine water invertebrates
Effect concentration:
3.5 mg/L

Additional information