Registration Dossier
Registration Dossier
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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.
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EC number: 617-252-8 | CAS number: 81653-77-2
Melting point / freezing point
Administrative data
Link to relevant study record(s)
- Endpoint:
- melting point/freezing point
- Type of information:
- (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:
- SOFTWARE: EPIsuite v.4.11
SMILES OR OTHER IDENTIFIERS USED AS INPUT FOR THE MODEL: OC(=O)[C@@H]1C[C@@H](CN1)Sc2ccccc2 - Principles of method if other than guideline:
- vapour pressure EPI prediction
- GLP compliance:
- no
- Type of method:
- other: prediction
- Melting / freezing pt.:
- ca. 300.58 °C
- Remarks on result:
- other: Atm not available
- Conclusions:
- 300.58 °C
- Executive summary:
The melting poing was estimated to be 300.58 °C.
Reference
Description of key information
Key value for chemical safety assessment
- Melting / freezing point at 101 325 Pa:
- 300.58 °C
Additional information
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.
