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EC number: 212-889-4 | CAS number: 877-24-7
Biodegradation in water and sediment: simulation tests
Administrative data
Link to relevant study record(s)
- Endpoint:
- biodegradation in water: sediment simulation testing
- Type of information:
- calculation (if not (Q)SAR)
- Adequacy of study:
- key study
- Reliability:
- 2 (reliable with restrictions)
- Rationale for reliability incl. deficiencies:
- accepted calculation method
- Justification for type of information:
- Data is from computational model developed by USEPA
- Qualifier:
- according to guideline
- Guideline:
- other: Modeling database
- Principles of method if other than guideline:
- Fugacity Model by EPI Suite estimation database
- GLP compliance:
- not specified
- Specific details on test material used for the study:
- CAS number: 877-24-7
EC number: 212-889-4
- Name of test material (as cited in study report): 1,2-Benzenedicarboxylic acid, monopotassium salt
- Molecular formula (if other than submission substance): C8H6O4.K
- Molecular weight (if other than submission substance): 204.221 g/mol
- Smiles notation (if other than submission substance): c1(c(cccc1)C(=O)[O-])C(O)=O.[K+]
- InChI:1S/C8H6O4.K/c9-7(10)5-3-1-2-4-6(5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+1/p-1
- Substance type: Organic
- Physical state: Solid - Radiolabelling:
- not specified
- Oxygen conditions:
- other: estimation
- Inoculum or test system:
- not specified
- Parameter followed for biodegradation estimation:
- test mat. analysis
- Compartment:
- water
- % Recovery:
- 20
- Compartment:
- sediment
- % Recovery:
- 0.102
- Key result
- % Degr.:
- 50
- Parameter:
- other: Half-life in water
- Sampling time:
- 15 d
- Remarks on result:
- other: Other details not known
- Key result
- % Degr.:
- 50
- Parameter:
- other: Half-life in sediment
- Sampling time:
- 135 d
- Remarks on result:
- other: Other details not known
- Key result
- Compartment:
- water
- DT50:
- 15 d
- Type:
- other: estimated data
- Temp.:
- 25 °C
- Remarks on result:
- other: Other details not known
- Key result
- Compartment:
- sediment
- DT50:
- 135 d
- Type:
- other: estimated data
- Temp.:
- 25 °C
- Remarks on result:
- other: Other details not known
- Transformation products:
- not specified
- Validity criteria fulfilled:
- not specified
- Conclusions:
- Estimated half life of 1,2-Benzenedicarboxylic acid, monopotassium salt in water was 15 days (360 h) and in sediment estimated to be 135 days (3240 h).
- Executive summary:
Estimation Programs Interface (EPI) Suite (2017) prediction model was run to predict the half-life in water and sediment for the test compound 1,2-Benzenedicarboxylic acid, monopotassium salt (CAS No. 877 -24 -7). If released in to the environment, 20% of the chemical will partition into water according to the Mackay fugacity model level III and the half-life period of 1,2-Benzenedicarboxylic acid, monopotassium salt in water is estimated to be 15 days (360hrs). The half-life (15 days estimated by EPI suite) indicates that the chemical is not persistent in water and the exposure risk to aquatic animals is low whereas the half-life period of 1,2-Benzenedicarboxylic acid, monopotassium salt in sediment is estimated to be 135 days (3240 hrs). However, as the percentage release of the chemical into the sediment is less than 1% (i.e, reported as 0.102%), indicates that 1,2-Benzenedicarboxylic acid, monopotassium salt is not persistent in nature.
Reference
Mass Amount (percent) |
Half-Life (hr) |
Emissions (kg/hr) |
|
Water |
20 |
360 |
1000 |
Sediment |
0.102 |
3.24e+003 |
0 |
Fugacity (atm) |
Reaction (kg/hr) |
Advection (kg/hr) |
Reaction (percent) |
Advection (percent) |
|
Water |
2.73e-023 |
854 |
443 |
28.5 |
14.8 |
Sediment |
2.37e-023 |
0.485 |
0.0453 |
0.0162 |
0.00151 |
Description of key information
Estimation Programs Interface (EPI Suite, 2017) prediction model was run to predict the half-life in water and sediment for the test compound 1,2-Benzenedicarboxylic acid, monopotassium salt (CAS No. 877 -24 -7). If released in to the environment, 20% of the chemical will partition into water according to the Mackay fugacity model level III and the half-life period of 1,2-Benzenedicarboxylic acid, monopotassium salt in water is estimated to be 15 days (360hrs). The half-life (15 days estimated by EPI suite) indicates that the chemical is not persistent in water and the exposure risk to aquatic animals is low whereas the half-life period of 1,2-Benzenedicarboxylic acid, monopotassium salt in sediment is estimated to be 135 days (3240 hrs). However, as the percentage release of the chemical into the sediment is less than 1% (i.e, reported as 0.102%), indicates that 1,2-Benzenedicarboxylic acid, monopotassium salt is not persistent in nature.
Key value for chemical safety assessment
- Half-life in freshwater:
- 15 d
- at the temperature of:
- 25 °C
- Half-life in freshwater sediment:
- 135 d
- at the temperature of:
- 25 °C
Additional information
Estimation Programs Interface (EPI Suite, 2017) prediction model was run to predict the half-life in water and sediment for the test compound 1,2-Benzenedicarboxylic acid, monopotassium salt (CAS No. 877 -24 -7). If released in to the environment, 20% of the chemical will partition into water according to the Mackay fugacity model level III and the half-life period of 1,2-Benzenedicarboxylic acid, monopotassium salt in water is estimated to be 15 days (360hrs). The half-life (15 days estimated by EPI suite) indicates that the chemical is not persistent in water and the exposure risk to aquatic animals is low whereas the half-life period of 1,2-Benzenedicarboxylic acid, monopotassium salt in sediment is estimated to be 135 days (3240 hrs). However, as the percentage release of the chemical into the sediment is less than 1% (i.e, reported as 0.102%), indicates that 1,2-Benzenedicarboxylic acid, monopotassium salt is not persistent in nature.
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