ChemicalBook > CAS DataBase List > 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE

4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE

Product Name: 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE
CAS No.: 16097-63-5
Chemical Name: 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE
Synonyms: NSC 64344;BUTTPARK 6\01-56;SPECS AG-996/31082064;4-CHLORO-2-METHYLTHIO-6-(TRIFLUOROMETHYL)PYRIMIDINE;Pyrimidine, 4-chloro-2-(methylthio)-6-(trifluoromethyl)-;4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE;4-Chloro-2-(methylthio)-6-(trifluoromethyl)pyrimidine ,97%;4-Chloro-2-(Methylsulfanyl)-6-(trifluoroMethyl)pyriMidine (en);JR-8836, 4-Chloro-2-methylthio-6-(trifluoromethyl)pyrimidine, 97%;4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE ISO 9001：2015 REACH
CBNumber: CB4757186
Molecular Formula: C6H4ClF3N2S
Formula Weight: 228.62
MOL File: 16097-63-5.mol

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4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE Property

Melting point:: 38-39℃ (ethyl acetate ligroine )
Boiling point:: 83.5℃ (9.3 Torr)
Density: 1.52±0.1 g/cm3(Predicted)
refractive index: 1.5050 (25℃)
storage temp.: under inert gas (nitrogen or Argon) at 2-8°C
pka: -5.28±0.32(Predicted)
form: Liquid
color: Colorless
Sensitive: Stench

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Safety

Hazard Codes: Xi,T
Risk Statements: 36/37/38-25
Safety Statements: 26-36/37/39-45
Hazard Note: Irritant/Stench
HazardClass: IRRITANT
HS Code: 29335990

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

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N-Bromosuccinimide Price

TRC

Product number: C381615
Product name: 4-Chloro-2-(methylsulfanyl)-6-(trifluoromethyl)pyrimidine
Packaging: 100mg
Price: $60
Updated: 2021/12/16

Frontier Specialty Chemicals

Product number: C11424
Product name: 4-Chloro-2-(methylthio)-6-(trifluoromethyl)pyrimidine
Packaging: 1g
Price: $20
Updated: 2021/12/16

Matrix Scientific

Product number: 045340
Product name: 4-Chloro-2-(methylsulfanyl)-6-(trifluoromethyl)-pyrimidine
Purity: >95%
Packaging: 500mg
Price: $26
Updated: 2021/12/16

Matrix Scientific

Product number: 045340
Product name: 4-Chloro-2-(methylsulfanyl)-6-(trifluoromethyl)-pyrimidine
Purity: >95%
Packaging: 1g
Price: $39
Updated: 2021/12/16

SynQuest Laboratories

Product number: 7H66-7-01
Product name: 4-Chloro-2-(methylthio)-6-(trifluoromethyl)pyrimidine
Packaging: 500mg
Price: $84
Updated: 2021/12/16

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4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE Chemical Properties,Usage,Production

Chemical Properties

Colorless liquid

Uses

4-Chloro-2-(methylsulfanyl)-6-(trifluoromethyl)pyrimidine can be used as potent antiviral agents.

Synthesis

16097-62-4

16097-63-5

General procedure for the synthesis of 4-chloro-2-methylthio-6-trifluoromethylpyrimidines from 6-trifluoromethyl-4-hydroxy-2-methylthiopyrimidines: 2-(methylthio)-6-(trifluoromethyl)pyrimidin-4-ol (43-01) (1.4 g, 6.67 mmol) was dissolved in phosphorus oxychloride (POCl3, 15 mL) and the reaction was carried out under reflux for 3 h at 120 °C. The reaction was carried out under vacuum. Upon completion of the reaction, the mixture was cooled to room temperature and the excess POCl3 was subsequently removed under vacuum.The residue was extracted three times with dichloromethane (DCM) and ice water. The organic phases were combined, washed with saturated brine, dried over anhydrous sodium sulfate (Na2SO4), and concentrated under reduced pressure to afford 1.38 g of 4-chloro-2-(methylthio)-6-(trifluoromethyl)pyrimidine as a light yellow oil in 90% yield. Analyzed by liquid chromatography-mass spectrometry (LC-MS, ESI), the molecular ion peak m/z was measured to be 229.0 [C6H5ClF3N2S+], which was consistent with the theoretically calculated value.

References

[1] ACS Medicinal Chemistry Letters, 2017, vol. 8, # 4, p. 407 - 412
[2] Patent: WO2018/14802, 2018, A1. Location in patent: Paragraph 0232
[3] Journal of Heterocyclic Chemistry, 1983, vol. 20, # 1, p. 219 - 223
[4] Patent: WO2010/134478, 2010, A1. Location in patent: Page/Page column 182

4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE Preparation Products And Raw materials

Raw materials

Ethyl 4,4,4-trifluoroacetoacetate Hexane Ethanol Sodium Phosphorus oxitrichloride Methanol Isopropyl alcohol Thiourea Dimethyl sulfate

Preparation Products

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View Lastest Price from 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE manufacturers

Dideu Industries Group Limited

Product: 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE 16097-63-5
Price: US $1.10/g
Min. Order: 1g
Purity: 99.00%
Supply Ability: 100 Tons Min
Release date: 2021-12-07

Career Henan Chemical Co

Product: 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE 16097-63-5
Price: US $1.00/kg
Min. Order: 1kg
Purity: 98%
Supply Ability: 200kg
Release date: 2018-12-24

Career Henan Chemical Co

Product: 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE 16097-63-5
Price: US $1.00/kg
Min. Order: 1kg
Purity: 98%
Supply Ability: 200kg
Release date: 2018-12-24

16097-63-5, 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINERelated Search:

4-Chloro-6-trifluoromethylpyrimidine 4-Chloro-6-methyl-2-(methylthio)pyrimidine 4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE

SPECS AG-996/31082064

BUTTPARK 6\01-56

4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE

4-CHLORO-2-METHYLTHIO-6-(TRIFLUOROMETHYL)PYRIMIDINE

4-Chloro-2-(methylthio)-6-(trifluoromethyl)pyrimidine ,97%

4-Chloro-2-(Methylsulfanyl)-6-(trifluoroMethyl)pyriMidine (en)

4-Chloro-2-(methylsulphanyl)-6-(trifluoromethyl)pyrimidine, 4-Chloro-2-(methylsulphanyl)-6-(trifluoromethyl)-1,3-diazine

NSC 64344

JR-8836, 4-Chloro-2-methylthio-6-(trifluoromethyl)pyrimidine, 97%

Pyrimidine, 4-chloro-2-(methylthio)-6-(trifluoromethyl)-

4-CHLORO-2-(METHYLSULFANYL)-6-(TRIFLUOROMETHYL)PYRIMIDINE ISO 9001：2015 REACH

16097-63-5

C6H4ClF3N2S

Building Blocks

Pyrimidine