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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
(Q)SAR
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Justification for type of information:
QSAR prediction: migrated from IUCLID 5.6

Data source

Reference
Reference Type:
publication
Title:
Prediction of (Q)SAR model endpoint for phenol, 2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-(hexyloxy)-
Author:
OECD
Year:
2011
Bibliographic source:
not available
Report date:
2011

Materials and methods

Test guideline
Qualifier:
according to guideline
Guideline:
other: REACH guidance on QSARS R6, May/July 2008
Principles of method if other than guideline:
OECD QSAR TOOLBOX 2.2
GLP compliance:
no

Test material

Constituent 1
Chemical structure
Reference substance name:
2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-((hexyl)oxy)phenol
EC Number:
411-380-6
EC Name:
2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-((hexyl)oxy)phenol
Cas Number:
147315-50-2
Molecular formula:
C27H27N3O2
IUPAC Name:
2-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-(hexyloxy)phenol
Details on test material:
SMILES:

c1(-c2c(O)cc(OCCCCCC)cc2)nc(-c2ccccc2)nc(-c2ccccc2)n1

Results and discussion

Boiling point
Boiling pt.:
350 °C
Remarks on result:
other: The atm. pressure value is not available

Applicant's summary and conclusion