ChemicalBook > CAS DataBase List > 4-Chloro-6-methoxy-2-(methylthio)pyrimidine

4-Chloro-6-methoxy-2-(methylthio)pyrimidine

Product Name
4-Chloro-6-methoxy-2-(methylthio)pyrimidine
CAS No.
89466-42-2
Chemical Name
4-Chloro-6-methoxy-2-(methylthio)pyrimidine
Synonyms
4-Chloro-6-methoxy-2-(methylthio);6-methoxy-2-methylthio-4-chlorpyrimidine;4-CHLORO-6-METHOXY-2-(METHYLTHIO)PYRIMIDINE;Pyrimidine, 4-chloro-6-methoxy-2-(methylthio)-;4-Chloro-6-methoxy-2-(methylthio)pyrimidine ,98%
CBNumber
CB52129407
Molecular Formula
C6H7ClN2OS
Formula Weight
190.65
MOL File
89466-42-2.mol
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4-Chloro-6-methoxy-2-(methylthio)pyrimidine Property

Melting point:
38-39℃
Boiling point:
288℃
Density 
1.36
refractive index 
1.
Flash point:
128℃
storage temp. 
under inert gas (nitrogen or Argon) at 2-8°C
pka
-2.26±0.30(Predicted)
Appearance
white solid
InChI
InChI=1S/C6H7ClN2OS/c1-10-5-3-4(7)8-6(9-5)11-2/h3H,1-2H3
InChIKey
FNYLFWGITLMOHA-UHFFFAOYSA-N
SMILES
C1(SC)=NC(OC)=CC(Cl)=N1
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Safety

Risk Statements 
22
Safety Statements 
36/37
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.

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P271Use only outdoors or in a well-ventilated area.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352IF ON SKIN: wash with plenty of soap and water.

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.

P312Call a POISON CENTER or doctor/physician if you feel unwell.

P321Specific treatment (see … on this label).

P332+P313IF SKIN irritation occurs: Get medical advice/attention.

P337+P313IF eye irritation persists: Get medical advice/attention.

P362Take off contaminated clothing and wash before reuse.

P403+P233Store in a well-ventilated place. Keep container tightly closed.

P405Store locked up.

P501Dispose of contents/container to..…

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N-Bromosuccinimide Price

Biosynth Carbosynth
Product number
FC154020
Product name
4-Chloro-6-methoxy-2-(methylthio)pyrimidine ,98%
Packaging
50mg
Price
$66
Updated
2021/12/16
Biosynth Carbosynth
Product number
FC154020
Product name
4-Chloro-6-methoxy-2-(methylthio)pyrimidine ,98%
Packaging
100mg
Price
$114
Updated
2021/12/16
Biosynth Carbosynth
Product number
FC154020
Product name
4-Chloro-6-methoxy-2-(methylthio)pyrimidine ,98%
Packaging
250mg
Price
$227.5
Updated
2021/12/16
AK Scientific
Product number
Z2860
Product name
4-Chloro-6-methoxy-2-methylsulfanylpyrimidine
Packaging
1g
Price
$237
Updated
2021/12/16
Biosynth Carbosynth
Product number
FC154020
Product name
4-Chloro-6-methoxy-2-(methylthio)pyrimidine ,98%
Packaging
500mg
Price
$395
Updated
2021/12/16
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4-Chloro-6-methoxy-2-(methylthio)pyrimidine Chemical Properties,Usage,Production

Chemical Properties

White solid

Uses

4-chloro-6-methoxy-2-(methylthio)pyrimidine is a versatile scaffold and can undergo Suzuki-Miyaura coupling to afford 4-aryl-6-methoxy-2-(methylthio)pyrimidines, as well as amine or alcohol displacement of the chloride, oxidation to sulfone, and condensation reactions to give polycyclic systems][1].

Synthesis

67-56-1

6299-25-8

89466-42-2

To a reaction vial containing an ethanol solution (20 mL) of sodium (0.28 g, 12 mmol) was added 4,6-dichloro-2-(methylthio)pyrimidine (1.95 g, 10 mmol) and stirred at room temperature until the reaction was complete, the progress of the reaction was monitored by thin layer chromatography (TLC). After completion of the reaction, the solvent was removed by evaporation under reduced pressure and quenched by addition of water. Subsequently extracted with dichloromethane (CH2Cl2), the organic phase was washed with water and dried with anhydrous sodium sulfate (Na2SO4). The organic phase was concentrated under reduced pressure and the residue was recrystallized with ether to afford the target compound 6-methoxy-2-methylthio-4-chloropyrimidine (4 g) as a white solid in 70% yield with a melting point of 39-40°C. IR spectra (KBr, cm-1 ): 3003, 2939, 1544, 1328, 1274, 1505, 1030, 820. NMR hydrogen spectra ( 1H NMR, 400 MHz, CDCl3) δ: 2.55 (s, 3H, SCH3), 3.97 (s, 3H, OCH3), 6.41 (s, 1H, pyrimidine-H). Nuclear magnetic resonance carbon spectrum (13C NMR, 100 MHz, CDCl3): δ14.29, 54.52, 102.43, 160.34, 169.90, 172.92. liquid chromatography-mass spectrometry (LC-MS, m/z): 190.0. calculated elemental analysis values (C6H7ClN2OS): C, 37.80; H, 3.70; N 14.69. Measured values: C, 37.72; H, 3.75; N, 14.78.

References

[1] A. Kalogirou, P. Koutentis. “4-Chloro-6-ethoxy-2-(methylthio)pyrimidine.” Molbank 2017 1 (2016).

4-Chloro-6-methoxy-2-(methylthio)pyrimidine Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 4-Chloro-6-methoxy-2-(methylthio)pyrimidine manufacturers

Shaanxi Dideu Medichem Co. Ltd
Product
4-Chloro-6-Methoxy-2-Methylsulfanyl-pyriMidine 89466-42-2
Price
US $1.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
20T
Release date
2020-05-15

89466-42-2, 4-Chloro-6-methoxy-2-(methylthio)pyrimidineRelated Search:


  • 4-Chloro-6-methoxy-2-(methylthio)pyrimidine ,98%
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  • Pyrimidine, 4-chloro-6-methoxy-2-(methylthio)-
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  • 89466-42-2