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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
dissociation constant
Type of information:
calculation (if not (Q)SAR)
Remarks:
Migrated phrase: estimated by calculation
Adequacy of study:
supporting study
Reliability:
4 (not assignable)
Rationale for reliability incl. deficiencies:
other: Data from secondary source

Data source

Reference
Reference Type:
publication
Title:
NATIONAL INDUSTRIAL CHEMICALS NOTIFICATION AND ASSESSMENT SCHEME (NICNAS) - FULL PUBLIC REPORT - 4(3H)-Pyrimidinone, 2,6-diamino-
Author:
NICNAS
Year:
2010
Bibliographic source:
www.nicnas.gov.au; File No: STD/1346

Materials and methods

Principles of method if other than guideline:
Estimated using the principles of Taft and Hammett Correlations
GLP compliance:
not specified

Test material

Constituent 1
Chemical structure
Reference substance name:
2,6-diamino-1H-pyrimidin-4-one
EC Number:
200-254-4
EC Name:
2,6-diamino-1H-pyrimidin-4-one
Cas Number:
56-06-4
Molecular formula:
C4H6N4O
IUPAC Name:
2,6-diamino-1H-pyrimidin-4-one

Results and discussion

Dissociating properties:
yes
Dissociation constantopen allclose all
No.:
#1
pKa:
ca. 4.6
Temp.:
25 °C
No.:
#2
pKa:
ca. 5.2
Temp.:
25 °C

Any other information on results incl. tables

Based on the pKas of aniline and pyridine

Applicant's summary and conclusion