4,6-DICHLORO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID

Base Information

• Chemical Name: 4,6-DICHLORO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID
• CAS No.: 313339-35-4
• Molecular Formula: C6H4 Cl2 N2 O2 S
• Molecular Weight: 239.082
• Hs Code.: 2933599090
• Mol file: 313339-35-4.mol

Synonyms:4,6-Dichloro-2-(methylthio)pyrimidine-5-carboxylicacid; 4,6-Dichloro-5-carboxy-2-methylthiopyrimidine

Chemical Property of 4,6-DICHLORO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 159-163℃
• Boiling Point: 384.523ºC at 760 mmHg
• PKA: 0.08±0.32(Predicted)
• Flash Point: 186.353ºC
• PSA: 88.38000
• Density: 1.716g/cm3
• LogP: 2.20350
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C

Purity/Quality:

97% ^*data from raw suppliers

4,6-Dichloro-2-(methylthio)pyrimidine-5-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4,6-DICHLORO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID

There total 5 articles about 4,6-DICHLORO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.0%

4,6-Dichloro-2-(methylthio)pyrimidine (6299-25-8) + carbon dioxide (124-38-9,18923-20-1) → 4,6-dichloro-2-(methylsulfanyl)pyrimidine-5-carboxylic acid (313339-35-4)

Guidance literature:

4,6-Dichloro-2-(methylthio)pyrimidine; With lithium diisopropyl amide; In tetrahydrofuran; at -78 ℃; for 0.5h;

carbon dioxide; In tetrahydrofuran; for 0.5h;

DOI:10.1016/j.bmcl.2008.07.011

Reference yield: 58.0%

→ 4,6-dichloro-2-(methylsulfanyl)pyrimidine-5-carboxylic acid (313339-35-4)

Guidance literature:

Reference yield:

4,6-dichloro-2-methylsulfanylpyrimidine-5-carboxyaldehyde (33097-11-9) → 4,6-dichloro-2-(methylsulfanyl)pyrimidine-5-carboxylic acid (313339-35-4)

Guidance literature:

With sodium chlorite; aminosulfonic acid; In tetrahydrofuran; water; tert-butyl alcohol; at -10 - 35 ℃; for 0.166667h;

upstream raw materials:

4,6-Dichloro-2-(methylthio)pyrimidine

carbon dioxide

4,6-dihydroxy-2-methylmercaptopyrimidine

4,6-dichloro-2-methylsulfanylpyrimidine-5-carboxyaldehyde

Downstream raw materials:

6-[3,5-bis(trifluoromethyl)benzyl]-4-chloro-2-methylthio-5,6,7,8-tetrahydropyrimido[5,4-f][1,4]oxazepin-5-one

6-[3,5-bis(trifluoromethyl)benzyl]-4-chloro-2-methylthio-6,7,8,9-tetrahydro-5H-pyrimido[4,5-e][1,4]diazepin-5-one

6-[3,5-bis(trifluoromethyl)benzyl]-4-chloro-2-methylthio-5,6,7,8,9,10-hexahydropyrimido[4,5-b][1,5]diazocin-5-one

4,6-dichloro-2-methylsulfanyl-pyrimidine-5-carboxylic acid (3-amino-propyl)-(3,5-bis-trifluoromethyl-benzyl)-amide

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