ChemicalBook--->CAS DataBase List--->4214-85-1

4214-85-1

4214-85-1 Structure

4214-85-1 Structure
IdentificationBack Directory
[Name]

4(1H)-Pyrimidinone, 2-amino-6-methyl-5-nitro-
[CAS]

4214-85-1
[Synonyms]

2-aMino-6-Methyl-5-nitropyriMidin-4-ol
2-amino-6-methyl-5-nitropyrimidin-4(3H)-one
2-amino-6-methyl-5-nitro-1H-pyrimidin-4-one
2-amino-6-methyl-5-nitropyrimidin-4(1H)-one
2-Amino-6-methyl-5-nitro-4(3H)-pyrimidinone
2-amino-4-hydroxy-6-methyl-5-nitropyrimidine
2-azanyl-6-methyl-5-nitro-1H-pyrimidin-4-one
2-Amino-6-methyl-5-nitro-3H-pyrimidine-4-one
4(3H)-Pyrimidinone, 2-amino-6-methyl-5-nitro-
4(1H)-Pyrimidinone, 2-amino-6-methyl-5-nitro-
2-AMINO-4-HYDROXY-5-NITRO-6-METHYL-PYRIMIDINE
2-aMino-6-Methyl-5-nitro-3,4-dihydropyriMidin-4-one
4(1H)-Pyrimidinone, 2-amino-6-methyl-5-nitro- ISO 9001:2015 REACH
[Molecular Formula]

C5H6N4O3
[MDL Number]

MFCD06858762
[MOL File]

4214-85-1.mol
[Molecular Weight]

170.13
Chemical PropertiesBack Directory
[Melting point ]

>300 °C
[Boiling point ]

305.9±45.0 °C(Predicted)
[density ]

1.83±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C, protect from light
[pka]

7.18±0.50(Predicted)
[Appearance]

Light yellow to yellow Powder
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H332-H335
[Precautionary statements ]

P261-P280-P305+P351+P338
[HazardClass ]

IRRITANT
[HS Code ]

2933599590
Spectrum DetailBack Directory
[Spectrum Detail]

4(1H)-Pyrimidinone, 2-amino-6-methyl-5-nitro-(4214-85-1)1HNMR
Hazard InformationBack Directory
[Synthesis]

2-Amino-6-methyl-4-pyrimidinol

3977-29-5

4(1H)-Pyrimidinone, 2-amino-6-methyl-5-nitro-

4214-85-1

The general procedure for the synthesis of 2-amino-6-methyl-5-nitro-3H-pyrimidin-4-one from 2-amino-4-hydroxy-6-methylpyrimidine was as follows: 2-amino-6-methylpyrimidin-4(3H)-one (50 g, 0.4 mol) was dissolved in 250 mL of concentrated sulfuric acid at 0°C, and 40 mL of concentrated nitric acid was slowly added through a dropping funnel. The reaction mixture was stirred at room temperature for 3 hours and then slowly poured into 3.6 L of diethyl ether and continued stirring for 15 minutes. The ether layer was decanted off and 1.0 L of ethyl acetate was added to the remaining solid and stirred for 10 hours. The solid product (54.8 g, 81% yield) was collected by filtration, which could be used in subsequent reactions without further purification.

[References]

[1] Synthetic Communications, 2009, vol. 39, # 12, p. 2244 - 2249
[2] Journal of Heterocyclic Chemistry, 2009, vol. 46, # 6, p. 1151 - 1153
[3] Journal of Organic Chemistry, 1995, vol. 60, # 24, p. 7947 - 7952
[4] Patent: WO2006/122003, 2006, A2. Location in patent: Page/Page column 32; 34
[5] Nucleosides and Nucleotides, 1999, vol. 18, # 3, p. 363 - 376
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