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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Ecotoxicological information

Toxicity to aquatic plants other than algae

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Administrative data

Link to relevant study record(s)

Reference
Endpoint:
toxicity to aquatic plants other than algae
Type of information:
(Q)SAR
Adequacy of study:
weight of evidence
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 organic chemicals properties assessment.
Qualifier:
according to guideline
Guideline:
other: QSAR
Principles of method if other than guideline:
ECOSAR Program(v1.00)
GLP compliance:
no
Remarks:
not applicable to QSAR models
Analytical monitoring:
no
Vehicle:
no
Test organisms (species):
other: QSAR model
Test type:
other: QSAR model
Water media type:
freshwater
Limit test:
no
Total exposure duration:
30 d
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:
SMILES : O(C(=NCC)S)C(C)C
CHEM : Carbamothioic acid, ethyl-, O-(1-methylethyl) ester
CAS Number: 141-98-0
MOL FOR: C6 H13 N1 O1 S1
MOL WT : 147.24
Log Kow: 3.32 (KowWin estimate)
Wat Sol: 114.4 mg/L (WskowWin estimate)



Reference substance (positive control):
no
Duration:
96 h
Dose descriptor:
EC50
Effect conc.:
4.529 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
other: (Q)SAR prediction
Duration:
30 d
Dose descriptor:
NOEC
Effect conc.:
2.156 mg/L
Nominal / measured:
nominal
Conc. based on:
test mat.
Basis for effect:
other: (Q)SAR prediction
Details on results:
A 96 h LC50 value of 4.529 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group.
The data show the multi-component substances containing O-isopropyl ethylthiocarbamate and n-butanol and propan-2-ol
to be acutely toxic at concentrations of between 2.156-4.529 mg/L.
This result signifies that the test substance is expected to be moderately toxic.

A NOEC value of 2.156 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group.
This result signifies that the test substance is expected to be moderately toxic.
.

Overview of QSARs estimations onaquatic toxicity of O-isopropyl ethylthiocarbamate (IPETC ) to algae and aquatic plants

 

Method

 

Results

Remarks

Reference

QSAR

estimate

Green Algae, 96-hr EC50 =4.529mg/L (ppm)

Green Algae, 30-day, NOEC cited as a ChV value = 2.156mg/L(ppm)

 

Reliable with restrictions,

QSAR estimated data

ECOSAR Program (v1.00)

 

Green Algae, 96-hr EC50 =4.529mg/L (ppm)

Green Algae, 30-day, NOEC cited as a ChV value = 2.156 mg/L(ppm)

Validity criteria fulfilled:
yes
Remarks:
US EPA accepted QSAR method for organic chemicals properties assessment.
Conclusions:
A 96 h LC50 value of 4.529 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group.
The data show the multi-component substances containing O-isopropyl ethylthiocarbamate and n-butanol and propan-2-ol
to be acutely toxic at concentrations of between 2.156-4.529 mg/L.
This result signifies that the test substance is expected to be moderately toxic.

A NOEC value of 2.156 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group.
This result signifies that the test substance is expected to be moderately toxic.
.
Executive summary:

A 96 h LC50 value of 4.529 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group.

The data show the multi-component substances containing O-isopropyl ethylthiocarbamate and n-butanol and propan-2-ol

to be acutely toxic at concentrations of between 2.156-4.529 mg/L.

This result signifies that the test substance is expected to be moderately toxic.

A NOEC value of 2.156 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group.

This result signifies that the test substance is expected to be moderately toxic.

Description of key information

A 96 h LC50 value of 4.529 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group. 
The data show the multi-component substances containing O-isopropyl ethylthiocarbamate and n-butanol and propan-2-ol
to be acutely toxic at concentrations of between 2.156-4.529 mg/L.
This result signifies that the test substance is expected to be moderately toxic.
A NOEC value of 2.156 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group.
This result signifies that the test substance is expected to be moderately toxic.

Key value for chemical safety assessment

EC50 for freshwater plants:
4.529 mg/L
EC50 for marine water plants:
0.453 mg/L
EC10 or NOEC for freshwater plants:
2.156 mg/L
EC10 or NOEC for marine water plants:
0.216 mg/L

Additional information

A 96 h LC50 value of 4.529 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group.

The data show the multi-component substances containing O-isopropyl ethylthiocarbamate and n-butanol and propan-2-ol

to be acutely toxic at concentrations of between 2.156-4.529 mg/L.

This result signifies that the test substance is expected to be moderately toxic.

A NOEC value of 2.156 mg/L has been calculated for the effects of the test substance on the mortality of the Algae group.

This result signifies that the test substance is expected to be moderately toxic.

The available data for saltwater aquatic plants other than algae are limited and to obtaine the value for PNECs for saltwaters is taken account a assesment factor 10 to extrapolate to LC50 following the “Guidance on Information Requirement and Chemical Safety Assessment R.10: Characterisation of dose [concentration]- response for environment”and “Table R.10-5 Assessment factors proposed for deriving PNEC water for saltwater for different data sets”, to account for the possibility that greater taxonomic diversity in the marine environment makes it likely that some marine taxa may be more sensitive than the most sensitive freshwater taxa