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EC number: 305-632-3 | CAS number: 94891-32-4
Melting point / freezing point
Administrative data
Link to relevant study record(s)
- Endpoint:
- melting point/freezing point
- 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 modelling database developed by USEPA
- Qualifier:
- according to guideline
- Guideline:
- other: Estimated data
- Principles of method if other than guideline:
- MPBPVP v1.43 was used to estimate the Melting point of Aluminum, 2-(1,3-dihydro-1,3-dioxo-2H-inden-2-ylidene)-1,2-dihydro-6,7-quinolinedisulfonate complexes
- GLP compliance:
- not specified
- Type of method:
- other: Estimated by calculation
- Specific details on test material used for the study:
- - Name of test material : Aluminum, 2-(1,3-dihydro-1,3-dioxo-2H-inden-2-ylidene)-1,2-dihydro-6,7-quinolinedisulfonate complexes
- Molecular formula : C18H11NO8S2.Al
- Molecular weight : 460.39 g/mol
- Smiles notation : O=C1c2ccccc2C(=O)C1=C1C=Cc2cc3c4cc2N{-}1.[Al]{3+}(.O{-}S3(=O)=O).O{-}S4(=O)=O
- Substance type : Organic
- Physical state : Solid - Key result
- Melting / freezing pt.:
- 305 °C
- Decomposition:
- no
- Sublimation:
- no
- Remarks on result:
- other: Estimated value
- Conclusions:
- Based on prediction done using MPBPVP v1.43,the melting point of Aluminum, 2-(1,3-dihydro-1,3-dioxo-2H-inden-2-ylidene)-1,2-dihydro-6,7-quinolinedisulfonate complexes was estimated to be 305 Deg C.
- Executive summary:
Based on the prediction done using the EPI Suite MPVPBP V1.43,the melting point of aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes was predicted.
The melting point of aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes was estimated to be 305˚C.
Reference
Description of key information
Based on prediction done using MPBPVP v1.43, the melting point of Aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes was estimated to be 305 Deg C.
Key value for chemical safety assessment
- Melting / freezing point at 101 325 Pa:
- 305 °C
Additional information
Based on the prediction done using the EPI Suite MPVPBP V1.43,the melting point of aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes was predicted.
The melting point of aluminum, 2 -(1,3 -dihydro-1,3 -dioxo-2H-inden-2 -ylidene)-1,2 -dihydro-6,7 -quinolinedisulfonate complexes was estimated to be 305˚C.
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