Registration Dossier

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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

Administrative data

Endpoint:
boiling point
Type of information:
calculation (if not (Q)SAR)
Remarks:
Migrated phrase: estimated by calculation
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)

Data source

Reference
Reference Type:
publication
Title:
No information
Year:
2011
Bibliographic source:
ChemSpider data base

Materials and methods

Test guideline
Qualifier:
no guideline followed
Principles of method if other than guideline:
Predicted by EPISuite (Adapted Stein & Brown method)
GLP compliance:
no
Type of method:
other: prediction

Test material

Constituent 1
Chemical structure
Reference substance name:
L-Valine, N-[(1,1-dimethylethoxy)carbonyl]-, 2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]ethyl ester
EC Number:
610-513-7
Cas Number:
502421-44-5
Molecular formula:
C18H28N6O6
IUPAC Name:
L-Valine, N-[(1,1-dimethylethoxy)carbonyl]-, 2-[(2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy]ethyl ester

Results and discussion

Boiling point
Boiling pt.:
603.96 °C
Remarks on result:
other: other data not available

Applicant's summary and conclusion

Conclusions:
Predicted Boiling point: 603.96 °C