ChemicalBook--->CAS DataBase List--->7399-93-1

7399-93-1

7399-93-1 Structure

7399-93-1 Structure
IdentificationBack Directory
[Name]

Methyl 6-HydroxypyriMidine-4-carboxylate
[CAS]

7399-93-1
[Synonyms]

METHYL 6-HYDROXYPYRIMIDINE-4-CARBOXYLAT
methyl4-oxo-1H-pyrimidine-6-carboxylate
Methyl 6-HydroxypyriMidine-4-carboxylate
Methyl 6-oxo-1,6-dihydropyriMidine-4-carboxylate
Methyl 6-oxo-3,6-dihydropyriMidine-4-carboxylate
6-Oxo-3,6-dihydro-pyrimidine-4-carboxylic acid methyl ester
Methyl 6-HydroxypyriMidine-4-carboxylate ISO 9001:2015 REACH
4-PyriMidinecarboxylic acid, 1,6-dihydro-6-oxo-, Methyl ester
[Molecular Formula]

C6H6N2O3
[MDL Number]

MFCD00496785
[MOL File]

7399-93-1.mol
[Molecular Weight]

154.12
Chemical PropertiesBack Directory
[Boiling point ]

263.8±50.0 °C(Predicted)
[density ]

1.39±0.1 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[pka]

6.88±0.40(Predicted)
[Appearance]

Off-white to light brown Solid
Safety DataBack Directory
[HS Code ]

2933599590
Spectrum DetailBack Directory
[Spectrum Detail]

Methyl 6-HydroxypyriMidine-4-carboxylate(7399-93-1)1HNMR
Hazard InformationBack Directory
[Synthesis]

Methanol

67-56-1

6-Hydroxypyrimidine-4-carboxylic acid

6299-87-2

Methyl 6-HydroxypyriMidine-4-carboxylate

7399-93-1

Step 9A: Synthesis of methyl 6-oxo-1,6-dihydropyrimidine-4-carboxylate. 6-Hydroxy-4-pyrimidinecarboxylic acid (36.0 g, 257 mmol) was dissolved in methanol (360 mL), and chlorotrimethylsilane (56 g, 554 mmol) was slowly added dropwise. The reaction mixture was stirred at room temperature for 8 hours. Upon completion of the reaction, the solvent was removed by distillation under reduced pressure. The residual solid was mixed with 200 mL of methanol and refluxed for 30 minutes. After cooling to room temperature, the precipitated solid was collected by filtration and washed with a small amount of methanol. The product was dried under vacuum at 35 °C to give 27.9 g (70% yield) of methyl 6-oxo-3,6-dihydropyrimidine-4-carboxylate.1H NMR (300 MHz, DMSO-d6) data were as follows: δ (ppm) 12.50 (broad single peak, 1H), 8.23 (single peak, 1H), 6.83 (single peak, 1H), 3.80 (single peak, 3H).

[References]

[1] Patent: US2009/111821, 2009, A1. Location in patent: Page/Page column 23
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