Registration Dossier
Registration Dossier
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EC number: 234-293-3 | CAS number: 11071-15-1
Boiling point
Administrative data
- Endpoint:
- boiling point
- Type of information:
- calculation (if not (Q)SAR)
- Remarks:
- MPBPWIN
- Adequacy of study:
- weight of evidence
- Reliability:
- 2 (reliable with restrictions)
- Justification for type of information:
- 1. SOFTWARE: EPI SuiteTM
2. MODEL (incl. version number) MPBPWIN v1.43
3. SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL: O=C(C4O2)O[Sb]2(OC4C([O-])=O)=[Sb]1(OC3C([O-])=O)OC(C3O1)=O.[K+].[K+]
Data source
Reference
- Title:
- MPBPWIN v1.43
- Year:
- 2 012
- Bibliographic source:
- Adapted Stein and Brown Method
Materials and methods
Test guideline
- Guideline:
- other: REACH Guidance on QSARs R.6
- Principles of method if other than guideline:
- Stein, S.E. and Brown, R.L. 1994. Estimation of normal boiling points from group contributions. J. Chem. Inf. Comput. Sci. 34: 581-7.
Test material
- Reference substance name:
- Dipotassium bis[μ-[tartrato(4-)-O1,O2:O3,O4]]diantimonate(2-) , stereoisomer
- EC Number:
- 234-293-3
- EC Name:
- Dipotassium bis[μ-[tartrato(4-)-O1,O2:O3,O4]]diantimonate(2-) , stereoisomer
- Cas Number:
- 11071-15-1
- Molecular formula:
- C8H4O12Sb2.2K
- IUPAC Name:
- (2R,3R)-2,3-dihydroxy-butanedioic acid, antimony potassium salt
Constituent 1
- Specific details on test material used for the study:
- SMILES: O=C(C4O2)O[Sb]2(OC4C(=O)(OK))=[Sb]1(OC3C(=O)(OK))OC(=O)(C3O1)
Results and discussion
Boiling point
- Key result
- Boiling pt.:
- ca. 666.84 °C
- Remarks on result:
- other: QSAR predicted value
Any other information on results incl. tables
MPBPWIN predicted that Antimony Potassium Tartrate has a boiling point = 666.84 deg C
Applicant's summary and conclusion
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
Reproduction or further distribution of this information may be subject to copyright protection. Use of the information without obtaining the permission from the owner(s) of the respective information might violate the rights of the owner.
