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Ecotoxicological information

Short-term toxicity to fish

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Endpoint:
short-term toxicity to fish
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
Principles of method if other than guideline:
EPI Suite v 4.1/ECOSARv1.00
GLP compliance:
no
Remarks:
not applicable to QSAR models
Analytical monitoring:
not specified
Vehicle:
not specified
Test organisms (species):
other: Fishes species
Details on test organisms:
no further information
Test type:
other: QSAR model
Water media type:
freshwater
Limit test:
no
Total exposure duration:
96 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
Details on test conditions:
CAS Number:80206-82-2
SMILES : CCCCCCCCCCCCO
CHEM : Alcohols, C12-14
MOL FOR: C12 H26 O1
MOL WT : 186.34
Log Kow: 4.77 (KowWin estimate)
Wat Sol: 4 mg/L (experimental database)








Reference substance (positive control):
no
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
0.525 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
other: (Q)SAR prediction
Remarks on result:
other: non-toxic at the limit of solubility, as determined by (Q)SAR
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
131.25 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
other: (Q)SAR prediction
Remarks on result:
other: Predicted, at an water solubility loading rates of 1000 mg/L
Details on results:
A 96 h LC50 value of 0.525 mg/L has been calculated for the effects of the test substance on the mortality of the fish taxonomic group. This result signifies that the test substance is not expected to be toxic at the limit of solubility.
A reliable 96 h LC50 value of 131.25 mg/L has been calculated for the effects of the test substance towards fish taxonomic group.Therefore the test substance has been predicted to be non toxic at the limit of solubility, so the LC50 is 0.525 mg/L. Predicted to be non-toxic at the limit of solubility.
The water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database).This is about 250 times the water solubility of the test substance.
Results with reference substance (positive control):
A 96 h LC50 value of 0.525 mg/L has been calculated for the effects of the test substance on the mortality of the fish taxonomic group. This result signifies that the test substance is not expected to be toxic at the limit of solubility.
Validity criteria fulfilled:
yes
Remarks:
US EPA accepted QSAR method for chemicals properties assessment.
Conclusions:
A 96 h LC50 value of 0.525 mg/L has been calculated for the effects of the test substance on the mortality of the fish taxonomic group. This result signifies that the test substance is not expected to be toxic at the limit of solubility.
A reliable 96 h LC50 value of 131.25 mg/L has been calculated for the effects of the test substance towards fish taxonomic group.Therefore the test substance has been predicted to be non toxic at the limit of solubility, so the LC50 is 0.525 mg/L. Predicted to be non-toxic at the limit of solubility.
The water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database).This is about 250 times the water solubility of the test substance.
Executive summary:
The ECOSAR QSAR model predicts that the 96hr LC50 for freshwater fish would to be 0.525 mg/l .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 water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database). This is about 250 times the water solubility of the test substance.
Endpoint:
short-term toxicity to fish
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
Principles of method if other than guideline:
EPI Suite v 4.1/ECOSARv1.00
GLP compliance:
no
Remarks:
not applicable to QSAR models
Analytical monitoring:
not specified
Vehicle:
not specified
Test organisms (species):
other: Fishes species
Details on test organisms:
no further information
Test type:
other: QSAR model
Water media type:
saltwater
Limit test:
no
Total exposure duration:
96 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
Details on test conditions:
CAS Number:80206-82-2
SMILES : CCCCCCCCCCCCO
CHEM : Alcohols, C12-14
MOL FOR: C12 H26 O1
MOL WT : 186.34
Log Kow: 4.77 (KowWin estimate)
Wat Sol: 4 mg/L (experimental database)








Reference substance (positive control):
no
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
0.591 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
other: (Q)SAR prediction
Remarks on result:
other: non-toxic at the limit of solubility, as determined by (Q)SAR
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
147.75 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
other: (Q)SAR prediction
Remarks on result:
other: Predicted, at an water solubility loading rates of 1000 mg/L
Details on results:
A 96 h LC50 value of 0.591 mg/L has been calculated for the effects of the test substance on the mortality of the fish taxonomic group. This result signifies that the test substance is not expected to be toxic at the limit of solubility.
A reliable 96 h LC50 value of 147.75 mg/L has been calculated for the effects of the test substance towards fish taxonomic group.Therefore the test substance has been predicted to be non toxic at the limit of solubility, so the LC50 is 0.591 mg/L. Predicted to be non-toxic at the limit of solubility.
The water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database).This is about 250 times the water solubility of the test substance.
Results with reference substance (positive control):
A 96 h LC50 value of 0.591 mg/L has been calculated for the effects of the test substance on the mortality of the fish taxonomic group. This result signifies that the test substance is not expected to be toxic at the limit of solubility.
Validity criteria fulfilled:
yes
Remarks:
US EPA accepted QSAR method for chemicals properties assessment.
Conclusions:
A 96 h LC50 value of 0.591 mg/L has been calculated for the effects of the test substance on the mortality of the fish taxonomic group. 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.
A reliable 96 h LC50 value of 147.75 mg/L has been calculated for the effects of the test substance towards fish taxonomic group.Therefore the test substance has been predicted to be non toxic at the limit of solubility, so the LC50 is 0.591 mg/L. Predicted to be non-toxic at the limit of solubility.
The water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database).This is about 250 times the water solubility of the test substance.
Executive summary:
The ECOSAR QSAR model predicts that the 96hr LC50 for marinewater fish would to be 0.591 mg/l .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 water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database). This is about 250 times the water solubility of the test substance.
Endpoint:
short-term toxicity to fish
Type of information:
experimental study
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
study well documented, meets generally accepted scientific principles, acceptable for assessment
Qualifier:
according to guideline
Guideline:
OECD Guideline 203 (Fish, Acute Toxicity Test)
Principles of method if other than guideline:
German standard methods for the examination of water, waste water and sludge; bioassays (group L); determination of the effect of substances in water on fish-fish test (L15). Test method corresponds to OECD Guideline 203.
GLP compliance:
yes
Analytical monitoring:
no
Vehicle:
yes
Test organisms (species):
Leuciscus idus
Details on test organisms:
Species: Leuciscus idus (Fish, fresh water)
Test type:
static
Water media type:
freshwater
Limit test:
no
Total exposure duration:
48 h
Post exposure observation period:
none reported
Test temperature:
21.4 - 23.8C
pH:
pH mean: 6.6-7.5
Dissolved oxygen:
65-100% saturation
Salinity:
Not Applicable
Nominal and measured concentrations:
Concentrations: 0, 3000, 5000, 10000 mg/l
Renewal of test solution: daily
Exposure vessel type: 5 L aquarium
Details on test conditions:
Number of replicates: 1
Fish per replicate: 10
Test temperature: 21.4 - 23.8C
Dissolved oxygen: 65-100% saturation
pH mean: 6.6-7.5
Adjustment of pH: not reported
Photoperiod: not reported
DURATION OF THE TEST: 48 h
TEST PARAMETER: mortality
Reference substance (positive control):
no
Duration:
48 h
Dose descriptor:
LC50
Effect conc.:
> 5 000 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
mortality (fish)
Remarks on result:
other: non-toxic at the limit of solubility
Duration:
48 h
Dose descriptor:
LC0
Effect conc.:
3 000 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
mortality (fish)
Duration:
48 h
Dose descriptor:
LC100
Effect conc.:
> 10 000 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
mortality (fish)
Details on results:
RESULTS: EXPOSED
LC0 = 3000 mg/l
LC50 > 5000 mg/l
LC100 > 10000 mg/l
Based on nominal concentrations
RESULTS: CONTROL
Number/% showing adverse effects: Not reported
Validity criteria fulfilled:
yes
Conclusions:
A 48 h LC50 >5000 mg/L has been determined for the effects of Alcohols, C12-14 on the mortality of the freshwater fish Leuciscus idus . However this result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS.


Executive summary:

A 48 h LC50 >5000 mg/L has been determined for the effects of Alcohols, C12-14 on the mortality of the freshwater fish Leuciscus idus . However this result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS.

Endpoint:
short-term toxicity to fish
Type of information:
other: published data
Adequacy of study:
weight of evidence
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
study well documented, meets generally accepted scientific principles, acceptable for assessment
Qualifier:
according to guideline
Guideline:
OECD Guideline 203 (Fish, Acute Toxicity Test)
Deviations:
no
GLP compliance:
not specified
Analytical monitoring:
no
Vehicle:
yes
Test organisms (species):
Danio rerio (previous name: Brachydanio rerio)
Details on test organisms:
TEST ORGANISM

- Common name: rainbow trout

- Strain: Oncorhynchus mykiss

- Source: Donnington fish Farm, Upper Swell, Gloucestershire, UK

- Length at study initiation (length definition, mean, range and SD): 4.5 cm (SD = 0.2)

- Weight at study initiation (mean and range, SD): 1.2 g (SD = 0.26)

- Feeding during test: no the animals were starved from 24 h prior to the study initiation


ACCLIMATION

- Acclimation period: 7 days

- Acclimation conditions (same as test or not): yes

- Type and amount of food: commercial trout pellets

- Health during acclimation (any mortality observed): 2% mortality
Test type:
semi-static
Water media type:
freshwater
Limit test:
yes
Total exposure duration:
96 h
Post exposure observation period:
none reported
Hardness:
none reported
Test temperature:
none reported
pH:
range: 7.4-7.9
Dissolved oxygen:
none reported
Salinity:
Not Applicable
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
> 10 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
mortality (fish)
Remarks on result:
other: non-toxic at the limit of solubility
Details on results:
Five acute toxicity tests were conducted with hexadecanol using four different preparation methods. None of the tests resulted in significant mortality due to the action of hexadecanol. Although the deaths in the control (typicaly 10-30%) complicate the interpretation, the data demonstrate that the 96 hour LC50 was greater than the highest concentration tested (10 mg/L). This is about 1000 times the water solubility of hexadecanol.
Validity criteria fulfilled:
yes
Conclusions:
A 96 h LC50 >10 mg/L has been determined for the effects of hexadecanol on the mortality of the freshwater fish Brachydanio rerio (new name: Danio rerio). However this result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS.
Executive summary:

Five acute toxicity tests were conducted with hexadecanol using four different preparation methods. None of the tests resulted in significant mortality due to the action of hexadecanol. Although the deaths in the control (typicaly 10-30%) complicate the interpretation, the data demonstrate that the 96 hour LC50 was greater than the highest concentration tested (10 mg/L). This is about 1000 times the water solubility of hexadecanol.

Endpoint:
short-term toxicity to fish
Type of information:
other: published data
Adequacy of study:
weight of evidence
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
study well documented, meets generally accepted scientific principles, acceptable for assessment
Justification for type of information:
Dodecan-1-ol (C12) is supporting substance for Alcohols,C12-C14 and the main component.
Qualifier:
according to guideline
Guideline:
other: US EPA 1975
GLP compliance:
not specified
Analytical monitoring:
yes
Details on sampling:
- Sampling method: Concentrations of chemicals in water were measured in each tank throughout the test in all exposure treatments, although analysis details (methods and results) were not reported.
Vehicle:
no
Details on test solutions:
PREPARATION AND APPLICATION OF TEST SOLUTION

- Method: the test substance was tested at a level below the limit of solubility, no details on the method of dispersion were provided
Test organisms (species):
Pimephales promelas
Details on test organisms:
TEST ORGANISM

- Common name: fathead minnow

- Source: Environmental Research Laboratory-Duluth culture

- Age at study initiation (mean): 30d

- Weight at study initiation (mean): 0.12 g

- Feeding during test: none


ACCLIMATION

- Acclimation period: not reported
Test type:
flow-through
Water media type:
freshwater
Limit test:
no
Total exposure duration:
96 h
Post exposure observation period:
None
Hardness:
56.3 mg/L as CaCO3
Test temperature:
25 ± 1°C
pH:
7.5
Dissolved oxygen:
>60%
Salinity:
N.A.
Nominal and measured concentrations:
Five concentrations were tested in order to obtain 0 to 100% mortality, the values were not reported.
Details on test conditions:
TEST SYSTEM

- Type of flow-through: proportional diluter

- No. of organisms per vessel: <30 fish per concentration

- No. of vessels per control: 2

- No. of vessels per concentration: 2


TEST MEDIUM / WATER PARAMETERS

- Source/preparation of dilution water: Lake Superior

- Alkalinity: 42.2 mg/L

- Intervals of water quality measurement: daily


EFFECT PARAMETERS MEASURED: mortality was recorded at 1, 3, 6, 12, 24, 48, 72 and 96h
Reference substance (positive control):
not specified
Duration:
96 h
Dose descriptor:
LC50
Effect conc.:
1.01 mg/L
Nominal / measured:
meas. (not specified)
Conc. based on:
not specified
Basis for effect:
mortality (fish)
Remarks on result:
other: non-toxic at the limit of solubility
Details on results:
- Mortality of control: The mortality values in the control are not reported; however fish mortalities were monitored daily.
Reported statistics and error estimates:
The LC50 was calculated using the trimmed Spearman-Karber method (Hamilton et al. 1977) on a PDP-11/70 computer.
Validity criteria fulfilled:
yes
Conclusions:
A reliable 96h LC50 of 1.01 mg/L has been determined for the effects of the test substance on mortality of the fish Pimephales promelas.This result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS.
Dodecan-1-ol (C12) is supporting substance for Alcohols,C12-C14 and the main component.
Executive summary:

A reliable 96h LC50 of 1.01 mg/L has been determined for the effects of the test substance on mortality of the fish Pimephales promelas.This result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS.

Dodecan-1-ol (C12) is supporting substance for Alcohols,C12-C14 and the main component.

Description of key information

A reliable 96 h LC50 value of 131.25 mg/L has been calculated for the effects of the test substance towards freshwater fish taxonomic group.Therefore the test substance has been predicted to be non toxic at the limit of solubility, so the LC50 is 0.525 mg/L. Predicted to be non-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 water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database).This is about 250 times the water solubility of the test substance.
A reliable 96 h LC50 value of 147.75 mg/L has been calculated for the effects of the test substance towards fish taxonomic group.Therefore the test substance has been predicted to be non toxic at the limit of solubility, so the LC50 is 0.591 mg/L. Predicted to be non-toxic at the limit of solubility.
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 water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database).This is about 250 times the water solubility of the test substance.
A reliable 48 h LC50 >5000 mg/L has been determined for the effects of Alcohols, C12-14 on the mortality of the freshwater fish Leuciscus idus . However this result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS.

Key value for chemical safety assessment

Fresh water fish

Fresh water fish
Effect concentration:
131.25 mg/L

Marine water fish

Marine water fish
Effect concentration:
147.75 mg/L

Additional information

A reliable 96 h LC50 value of 131.25 mg/L has been calculated for the effects of the test substance towards freshwater fish taxonomic group.Therefore the test substance has been predicted to be non toxic at the limit of solubility, so the LC50 is 0.525 mg/L. Predicted to be non-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 water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database).This is about 250 times the water solubility of the test substance.

A reliable 96 h LC50 value of 147.75 mg/L has been calculated for the effects of the test substance towards fish taxonomic group.Therefore the test substance has been predicted to be non toxic at the limit of solubility, so the LC50 is 0.591 mg/L. Predicted to be non-toxic at the limit of solubility.

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 water solubility of the Alcohols, C12-14 is 4.0 mg/l at 1000 mg/L loading rate at 25 degC (experimental database).This is about 250 times the water solubility of the test substance.

A reliable 48 h LC50 >5000 mg/L has been determined for the effects of Alcohols, C12-14 on the mortality of the freshwater fish Leuciscus idus . However this result is above the LoS (limit of solubility), therefore the substance is non-toxic at the limit of LoS and LC50 is >LoS.