ChemicalBook--->CAS DataBase List--->16490-02-1

16490-02-1

16490-02-1 Structure

16490-02-1 Structure
IdentificationBack Directory
[Name]

4,6-PYRIMIDINE DICARBOXYLIC ACID
[CAS]

16490-02-1
[Synonyms]

NSC 44347
6-PYRIMIDINE DICARBOXYLIC ACID
4,6-PYRIMIDINE DICARBOXYLIC ACID
[Molecular Formula]

C6H4N2O4
[MDL Number]

MFCD00094473
[MOL File]

16490-02-1.mol
[Molecular Weight]

168.11
Chemical PropertiesBack Directory
[Melting point ]

238-240℃
[Boiling point ]

497.4±30.0 °C(Predicted)
[density ]

1.665±0.06 g/cm3 (20 ºC 760 Torr)
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

solid
[pka]

2.14±0.10(Predicted)
[color ]

White
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933599590
Hazard InformationBack Directory
[Uses]

4,6-Pyrimidinedicarboxylic Acid is used in the preparation of inhibitor scaffolds that inhibit the human 2-oxoglutarate-dependent JMJD2 subfamily of histone demethylases.
[Synthesis]

DIMETHYL PYRIMIDINE-4,6-DICARBOXYLATE

6345-43-3

4,6-PYRIMIDINE DICARBOXYLIC ACID

16490-02-1

General procedure for the synthesis of pyrimidine-4,6-dicarboxylic acid from dimethyl pyrimidine-4,6-dicarboxylate: To a solution of dimethyl pyrimidine-4,6-dicarboxylate (170 mg, 0.87 mmol) in methanol (5 mL) was added 1 N sodium hydroxide solution (5 mL, 5.00 mmol). The reaction mixture was stirred at room temperature for 2 hours. Upon completion of the reaction, the solvent was removed by evaporation and the resulting concentrated solution was acidified to pH 2-3 with 5 N hydrochloric acid.The resulting white precipitate was collected by filtration and washed with distilled water (2 mL) to give the final pyrimidine-4,6-dicarboxylic acid (125 mg, 86% yield).

[References]

[1] Journal of Medicinal Chemistry, 2008, vol. 51, # 22, p. 7053 - 7056
[2] Patent: WO2010/43866, 2010, A2. Location in patent: Page/Page column 77
Spectrum DetailBack Directory
[Spectrum Detail]

4,6-PYRIMIDINE DICARBOXYLIC ACID(16490-02-1)1HNMR
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