ChemicalBook--->CAS DataBase List--->57401-76-0

57401-76-0

57401-76-0 Structure

57401-76-0 Structure
IdentificationBack Directory
[Name]

2-AMINO-PYRIMIDINE-5-CARBOXYLIC ACID ETHYL ESTER
[CAS]

57401-76-0
[Synonyms]

EOS-60351
NSC 165511
5-Carbethoxy-2-pyriMidinaMine
ETHYL 2-AMINO-5-PYRIMIDINECARBOXYLATE
2-Amino-5-pyrimidinecarboxylic acid ethyl ester
2-AMINO-PYRIMIDINE-5-CARBOXYLIC ACID ETHYL ESTER
5-PyriMidinecarboxylic acid, 2-aMino-, ethyl ester
2-AMINO-PYRIMIDINE-5-CARBOXYLIC ACID ETHYL ESTER ISO 9001:2015 REACH
[Molecular Formula]

C7H9N3O2
[MDL Number]

MFCD04114100
[MOL File]

57401-76-0.mol
[Molecular Weight]

167.17
Chemical PropertiesBack Directory
[Melting point ]

147-149℃
[Boiling point ]

349℃
[density ]

1.261
[Fp ]

165℃
[storage temp. ]

2-8°C(protect from light)
[pka]

1.94±0.10(Predicted)
[Appearance]

White to light yellow Solid
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
Raw materials And Preparation ProductsBack Directory
[Raw materials]

ETHYL 2-(METHYLSULFONYL)PYRIMIDINE-5-CARBOXYLATE-->Ammonium hydroxide-->Acetonitrile
Hazard InformationBack Directory
[Uses]

2-Amino-pyrimidine-5-carboxylic Acid Ethyl Ester is a reagent used in the synthesis of retinoidal pyrimidinecarboxylic acids.
[Synthesis]

ETHYL 2-(METHYLSULFONYL)PYRIMIDINE-5-CARBOXYLATE

148550-51-0

2-AMINO-PYRIMIDINE-5-CARBOXYLIC ACID ETHYL ESTER

57401-76-0

The general procedure for the synthesis of ethyl 2-aminopyrimidine-5-carboxylate from ethyl 2-methylsulfonyl-5-pyrimidinecarboxylate was as follows: ethyl 2-(methylsulfonyl)pyrimidine-5-carboxylate (2.15 g, 9.34 mmol) was dissolved in acetonitrile (11.7 mL) and stirred at room temperature. Subsequently, 32% aqueous ammonium hydroxide solution (11.36 mL, 93 mmol) was added slowly and dropwise. The reaction mixture transformed into a white suspension within seconds. The acetonitrile was removed by rotary evaporator and the remaining aqueous phase suspension was filtered through a Brinell funnel. The resulting solid was washed with distilled water (20 mL) and dried to give ethyl 2-aminopyrimidine-5-carboxylate as a white solid (1.192 g, 7.13 mmol, 76% yield, MS/ESI+ 168.1 [MH]+).

[References]

[1] Patent: US2013/79313, 2013, A1. Location in patent: Paragraph 1024
[2] Patent: WO2013/45280, 2013, A1. Location in patent: Page/Page column 276
Spectrum DetailBack Directory
[Spectrum Detail]

2-AMINO-PYRIMIDINE-5-CARBOXYLIC ACID ETHYL ESTER(57401-76-0)1HNMR
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