ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE

Product Name: ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE
CAS No.: 776-53-4
Chemical Name: ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE
Synonyms: 4-Amino-2-(methylthio)-;4-AMINO-2-METHYLSULFANYL-PYRIMIDINE-5-CA...;hyl 4-aMino-2-(Methylthio)pyriMidine-5-carboxylate;Ethyl 4-amino-2-(methylthio)pyrimidin-5-carboxylate;thyl 4-aMino-2-(Methylthio)pyriMidine-5-carboxylate;Ethyl 4-aMino-2-(Methylthio)-5-pyriMidinecarboxylate;ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE;ethyl 4-amino-2-methylsulfanyl-pyrimidine-5-carboxylate;ETHYL-4-AMINO-2-METHYL MERCAPTO-PYRIMIDINE-4-CARBOXYLATE;ethyl 4-azanyl-2-methylsulfanyl-pyrimidine-5-carboxylate
CBNumber: CB8664107
Molecular Formula: C8H11N3O2S
Formula Weight: 213.26
MOL File: 776-53-4.mol

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ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE Property

Melting point:: 127-128 °C
Boiling point:: 370.3±22.0 °C(Predicted)
Density: 1.31±0.1 g/cm3(Predicted)
storage temp.: Keep in dark place,Inert atmosphere,Room temperature
form: solid
pka: 2.46±0.10(Predicted)
Appearance: White to off-white Solid
InChI: InChI=1S/C8H11N3O2S/c1-3-13-7(12)5-4-10-8(14-2)11-6(5)9/h4H,3H2,1-2H3,(H2,9,10,11)
InChIKey: QINRQIZOBCQKAZ-UHFFFAOYSA-N
SMILES: C1(SC)=NC=C(C(OCC)=O)C(N)=N1

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Safety

Hazard Codes: Xi
Risk Statements: 43
Safety Statements: 36/37-24/25
HS Code: 29335990

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H410Very toxic to aquatic life with long lasting effects

Precautionary statements

P273Avoid release to the environment.

P391Collect spillage. Hazardous to the aquatic environment

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

TRC

Product number: A618240
Product name: 4-Amino-2-(methylthio)-5-pyrimidinecarboxylicAcidEthylEster
Packaging: 1g
Price: $1175
Updated: 2021/12/16

Frontier Specialty Chemicals

Product number: E13733
Product name: Ethyl4-amino-2-(methylthio)pyrimidine-5-carboxylate
Purity: 97%
Packaging: 1g
Price: $18
Updated: 2021/12/16

SynQuest Laboratories

Product number: 8H66-1-19
Product name: Ethyl 4-amino-2-(methylthio)pyrimidine-5-carboxylate
Packaging: 250mg
Price: $25
Updated: 2021/12/16

AK Scientific

Product number: W8420
Product name: Ethyl4-amino-2-(methylthio)pyrimidin-5-carboxylate
Packaging: 1g
Price: $38
Updated: 2021/12/16

SynQuest Laboratories

Product number: 8H66-1-19
Product name: Ethyl 4-amino-2-(methylthio)pyrimidine-5-carboxylate
Packaging: 1g
Price: $55
Updated: 2021/12/16

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ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE Chemical Properties,Usage,Production

Chemical Properties

White solid

Uses

Ethyl 4-amino-2-(methylthio)pyrimidine-5-carboxylate is used for preparation of pyrimidopyrimidines as protein kinase inhibitors.

Synthesis

5909-24-0

776-53-4

Step 1. Ethyl 4-chloro-2-(methylthio)pyrimidine-5-carboxylate (100 g, 0.43 mol), tetrahydrofuran (THF, 500 mL) and triethylamine (TEA, 186 mL, 1.29 mol) were added sequentially to a 2L three-neck flask. 28% aqueous ammonium hydroxide solution (400mL) was added in batches under stirring and the reaction temperature was controlled to be below 30°C. After 2 hrs of reaction, water (1000 mL) was added and THF was removed by vacuum distillation.The reaction mixture was filtered and the solid product was collected and dried under vacuum at 50 °C to afford ethyl 4-amino-2-(methylthio)pyrimidine-5-carboxylate as a white solid (90 g, 99% yield). The product was analyzed by LC/MS showing m/z = 213.9 [M+H]+; 1H-NMR (DMSO-d6, 400MHz) δ 8.57 (s, 1H), 8.03 (br, 1H), 7.65 (br, 1H), 4.27 (q, J = 7.5Hz, 2H), 2.46 (s, 3H), 1.29 (t, J = 7.2Hz , 3H).

References

[1] Patent: US2015/31674, 2015, A1. Location in patent: Paragraph 0319
[2] ACS Medicinal Chemistry Letters, 2015, vol. 6, # 12, p. 1241 - 1246
[3] Journal of Medicinal Chemistry, 2016, vol. 59, # 11, p. 5520 - 5541
[4] Patent: WO2014/182829, 2014, A1. Location in patent: Page/Page column 42
[5] Patent: WO2015/120049, 2015, A1. Location in patent: Page/Page column 126; 127

ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE Preparation Products And Raw materials

Raw materials

Ethanol Diethyl ethoxymethylenemalonate Sodium Phosphorus oxitrichloride Dimethyl sulfide Benzene 2-Methyl-2-thiopseudourea sulfate Acetic acid Ethyl (ethoxymethylene)cyanoacetate Thiourea Dimethyl sulfate

Preparation Products

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ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE Suppliers

Canada 1 China 156 Europe 1 France 1 Germany 3 India 2 Ukraine 2 United Kingdom 1 United States 21 Global 188

Chongqing AoShe Biological Chemical Co., Ltd.

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View Lastest Price from ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE manufacturers

Dideu Industries Group Limited

Product: ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE 776-53-4
Price: US $1.10/g
Min. Order: 1g
Purity: 99.00%
Supply Ability: 100 Tons Min
Release date: 2021-12-10

Career Henan Chemical Co

Product: 4-AMINO-2-METHYLSULFANYL-PYRIMIDINE-5-CARBOXYLIC ACID ETHYL ESTER 776-53-4
Price: US $1.00/kg
Min. Order: 1kg
Purity: 98%
Supply Ability: 100KG
Release date: 2018-12-22

776-53-4, ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATERelated Search:

Oxazole-2-carboxylic acid Ethyl 6-bromoimidazo[1,2-a]pyridine-2-carboxylate ethyl 5-aMino-2-(2,6-difluorophenyl)thiazole-4-carboxylate ethyl 5,7-difluoroquinoline-3-carboxylate Ethyl 6-chloroimidazo[1,2-a]pyridine-2-carboxylate Ethyl 4-amino-2-(ethylthio)-5-pyrimidinecarboxylate ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE 4-AMINOPYRIMIDINE-5-CARBOXYLIC ACID 4-Aminopyrimidine {[4-AMINO-5-(ETHOXYCARBONYL)PYRIMIDIN-2-YL]THIO}ACETIC ACID ETHYL 4-(4-CHLOROANILINO)-2-(METHYLSULFANYL)-5-PYRIMIDINECARBOXYLATE ETHYL 4-(BENZYLAMINO)-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE ETHYL 4-(3,4-DICHLOROANILINO)-2-(METHYLSULFANYL)-5-PYRIMIDINECARBOXYLATE ETHYL 4-(METHYLAMINO)-2-(METHYLSULFANYL)-5-PYRIMIDINECARBOXYLATE ETHYL 2-(METHYLSULFANYL)-4-PIPERIDINO-5-PYRIMIDINECARBOXYLATE ETHYL 2-(METHYLSULFANYL)-4-MORPHOLINO-5-PYRIMIDINECARBOXYLATE BUTTPARK 21\09-28 ETHYL 4-(DIMETHYLAMINO)-2-(METHYLSULFANYL)-5-PYRIMIDINECARBOXYLATE

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

ETHYL-4-AMINO-2-METHYL MERCAPTO-PYRIMIDINE-4-CARBOXYLATE

ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE

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

4-Amino-2-(methylsulphanyl)pyrimidine-5-carboxylic acid ethyl ester

ethyl 4-amino-2-methylsulfanyl-pyrimidine-5-carboxylate

Ethyl 4-amino-2-(methylthio)pyrimidine-5-carboxylate ,97%

Ethyl 4-amino-2-(methylthio)pyrimidin-5-carboxylate

Ethyl 4-amino-2-(methylsulfanyl)-5-pyrimidinecarboxylate

ethyl 4-azanyl-2-methylsulfanyl-pyrimidine-5-carboxylate

Ethyl 4-aMino-2-(Methylthio)-5-pyriMidinecarboxylate

4-Amino-2-(methylthio)-

4-Amino-2-(methylthio)-5-pyrimidinecarboxylic Acid Ethyl Ester

PyriMidin-5-carboxylic acid 4-aMino-2-(Methylthio)-, ethyl ester

hyl 4-aMino-2-(Methylthio)pyriMidine-5-carboxylate

thyl 4-aMino-2-(Methylthio)pyriMidine-5-carboxylate

4-AMINO-2-METHYLSULFANYL-PYRIMIDINE-5-CA...

5-PyriMidinecarboxylic acid, 4-aMino-2-(Methylthio)-, ethyl ester

JR-14015, Ethyl 4-amino-2-(methylthio)pyrimidine-5-carboxylate, 97%

ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE ISO 9001：2015 REACH

5-Pyrimidinecarboxylic acid, 4-amino-2-(methylthio)-, ethyl ester (6CI, 7CI, 8CI, 9CI, ACI)

4-amino-2-(methylthio)-5-Pyrimidinecarboxylic acid ethyl ester (6CI 7CI 8CI 9CI ACI)

ETHYL 4-AMINO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE, 10 mM in DMSO

776-53-4

Pyrimidine series

Amines

Aromatics

Heterocycles

Sulfur & Selenium Compounds