4-METHANESULFONYL-BENZOIC ACID METHYL ESTER Chemical Properties

Melting point:

118-120 °C

Boiling point:

377.8±34.0 °C(Predicted)

Density 

1.266±0.06 g/cm3(Predicted)

storage temp. 

Sealed in dry,Room Temperature

form 

solid

Appearance

White to off-white Solid

InChI

1S/C9H10O4S/c1-13-9(10)7-3-5-8(6-4-7)14(2,11)12/h3-6H,1-2H3

InChIKey

GUGXKWUWYBKREL-UHFFFAOYSA-N

SMILES

O=S(C(C=C1)=CC=C1C(OC)=O)(C)=O

Safety Information

WGK Germany 

WGK 3

HS Code 

2916310090

Storage Class

11 - Combustible Solids

4-METHANESULFONYL-BENZOIC ACID METHYL ESTER Usage And Synthesis

Application

Methyl 4-methanesulfonylbenzoate is an aryl sulfone compound that can be used as a pharmaceutical synthesis intermediate and an organic synthesis intermediate. It is mainly used in laboratory research and development processes and chemical and pharmaceutical synthesis processes.

Synthesis

In a reaction tube, 262 mg of ethyl p-iodobenzoate (MW = 262.04, 1.0 mmol) was added, followed by 153 mg of sodium salt of methyl ketene sulfonate (MW = 102.09, 1.2 mmol, 80%), 28 mg of sodium salt of L-proline (MW = 137.05, 0.2 mmol), 19 mg of CuI (MW = 190.45, 0.1 mmol), 2 ml of DMSO as a solvent, under the protection of nitrogen, the reaction was carried out in an oil bath at 80 ?? for 36 h. Cooling, 4 ml of water was added, and each time it was extracted with 10 ml of ethyl acetate, and repeated three times, and the extract was washed with saturated saline water, dried with anhydrous sodium sulfate, and then filtered, and the filtrate was distilled under reduced pressure, and separated over silica gel columns (the eluent petroleum ether: ethyl acetate = 3: 1 ), obtained 158 mg product 4-methylsulfonylbenzoic acid methyl ester, yield 77%.

4-METHANESULFONYL-BENZOIC ACID METHYL ESTER(22821-70-1)Related Product Information

• Benzoic acid, 4-(2-aminoethoxy)-, methyl ester, hydrochloride (1:1)
• methyl 4-(difluoromethyl)benzoate
• 4-(4-IODO-PHENOXY)-BENZOIC ACID METHYL ESTER
• METHYL 4-(PIPERAZIN-1-YL)BENZOATE
• Methyl 4-(2-hydroxyphenyl)butanoate
• Benzoic acid, 4-?(1-?azetidinylmethyl)?-?, methyl ester
• Methyl 4-(4-cyanophenoxy)benzoate
• 3,3,4,4-diphenylsulfonetetracarboxylicdianhydride
• METHYL 3-AMINO-4-(PHENYLSULFONYL)BENZENECARBOXYLATE
• RARECHEM AL BF 1445
• METHYL 3-NITRO-4-(PHENYLSULFONYL)BENZENECARBOXYLATE
• 4-METHANESULFONYL-BENZOIC ACID METHYL ESTER
• 4-METHANESULFONYL-BENZOIC ACID ETHYL ESTER
• DIMETHYL DIPHENYL SULFONE 4,4'-DICARBOXYLATE
• DI-N-BUTYL-4,4'-SULFONYLDIBENZOATE
• METHYL 3-AMINO-4-[(4-METHYLPHENYL)SULFONYL]BENZENECARBOXYLATE
• METHYL 4-[(4-METHYLPHENYL)SULFONYL]-3-[(2-THIENYLCARBONYL)AMINO]BENZENECARBOXYLATE
• METHYL 4-[(4-METHYLPHENYL)SULFONYL]-3-NITROBENZENECARBOXYLATE