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4-Methylsulphonylphenylacetic acid

CAS No.
90536-66-6
Chemical Name:
4-Methylsulphonylphenylacetic acid
Synonyms
TIMTEC-BB SBB009970;Etoricoxib?USP RC B;Etocoxib impurity 2;4-(Methylsulfonyl)ph;Etoricoxib impurity M;OTHER BUILDING BLOCKS;Etoricoxib Impurity 28;4-MESYLPHENYLACETIC ACID;4-Mesylbenzeneacetic acid;Etoricoxib Intermediate 5
CBNumber:
CB8339797
Molecular Formula:
C9H10O4S
Molecular Weight:
214.24
MDL Number:
MFCD00216495
MOL File:
90536-66-6.mol
MSDS File:
SDS
Last updated:2024-04-19 20:05:26

4-Methylsulphonylphenylacetic acid Properties

Melting point 136-140 °C(lit.)
Boiling point 324.37°C (rough estimate)
Density 1.4230 (rough estimate)
refractive index 1.6000 (estimate)
storage temp. Sealed in dry,Room Temperature
solubility DMSO (Slightly), Methanol (Slightly)
form Solid
pka 3.90±0.10(Predicted)
color White to Pale Yellow
Water Solubility slight
BRN 2646649
CAS DataBase Reference 90536-66-6(CAS DataBase Reference)
FDA UNII C39I2W89XI

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H319
Precautionary statements  P305+P351+P338
Hazard Codes  Xi
Risk Statements  36
Safety Statements  26
WGK Germany  3
Hazard Note  Irritant
HS Code  29309090
NFPA 704
0
2 0

4-Methylsulphonylphenylacetic acid price More Price(29)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 579114 4-(Methylsulfonyl)phenylacetic acid 97% 90536-66-6 1g $20 2023-06-20 Buy
Sigma-Aldrich 579114 4-(Methylsulfonyl)phenylacetic acid 97% 90536-66-6 5g $21 2023-06-20 Buy
TCI Chemical M1899 4-(Methylsulfonyl)phenylacetic Acid >98.0%(T) 90536-66-6 1g $28 2024-03-01 Buy
TCI Chemical M1899 4-(Methylsulfonyl)phenylacetic Acid >98.0%(T) 90536-66-6 5g $83 2024-03-01 Buy
Alfa Aesar L19504 4-(Methylsulfonyl)phenylacetic acid, 97% 90536-66-6 5g $51.65 2024-03-01 Buy
Product number Packaging Price Buy
579114 1g $20 Buy
579114 5g $21 Buy
M1899 1g $28 Buy
M1899 5g $83 Buy
L19504 5g $51.65 Buy

4-Methylsulphonylphenylacetic acid Chemical Properties,Uses,Production

Chemical Properties

yellow to beige-brown crystalline powder

Uses

4-(Methylsulfonyl)phenylacetic acid is an important raw material and intermediate used in organic synthesis, pharmaceuticals agrochemicals and dyestuff fields.

Preparation

synthesis of 4-(Methylsulfonyl)phenylacetic acid: 1-(4-Methanesulfonyl-phenyl)-ethanone (20 mmol), morpholine (60 mmol) and elemental sulfur (40 mmol) were added in a round-bottom flask and refluxed for 2 h at 398 K. A 3N solution of NaOH (20 ml) was then added, and the reaction mixture refluxed for an additional 30 min. After cooling, the mixture was filtered and the filtrate was acidified with HCl to pH 6. The solution was again filtered off and washed with ethyl acetate. The resulting aqueous fraction was finally acidified with diluted HCl, to yield the pure product as a white solid. Crystals suitable for X-ray analysis were obtained by slow evaporation of an ethanol/water (1:1 v/v) solution.

Application

4-(Methylsulfonyl)phenylacetic Acid is an intermediate used to prepare heterocyclic diaryl compounds as selective COX-2 inhibitors. It is also used to synthesize hydroxyfuranones as antioxidants and antiinflammatory agents.

109347-44-6
32703-82-5
Synthesis of 4-Methylsulphonylphenylacetic acid from 2-(4-methylsulfanylphenyl)acetaldehyde
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View Lastest Price from 4-Methylsulphonylphenylacetic acid manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
4-Methylsulphonylphenylacetic acid pictures 2024-04-20 4-Methylsulphonylphenylacetic acid
90536-66-6
US $50.00 / kg 1kg 99.10% 5000kg Ouhuang Engineering Materials (Hubei) Co., Ltd
4-Methylsulphonylphenylacetic acid pictures 2023-09-11 4-Methylsulphonylphenylacetic acid
90536-66-6
US $50.00 / kg 1kg 99% 10000tons Anhui Ruihan Technology Co., Ltd
4-(Methylsulfonyl)phenylacetic acid pictures 2023-09-07 4-(Methylsulfonyl)phenylacetic acid
90536-66-6
US $1.00 / kg 1kg 99% 20tons Hebei Yanxi Chemical Co., Ltd.
TIMTEC-BB SBB009970 4-MESYLPHENYLACETIC ACID 4-(METHANESULFONYL)PHENYLACETIC ACID 4-METHYLSULPHONYLPHENYLACETIC ACID 4-(METHYLSULFONYL)PHENYLACETIC ACID 4-methylsulfonyl benzeneacetic acid 4-(Methylsulfonyl)PhenylAceticAcid,Etoricoxib 4-Methyl Sulphonile Phenyle Acetic Acid 4-(Methanesulfonyl)phenylaceticacid,97% 4-Methylsulfonylphenylacetic Benzeneacetic acid, 4-(methylsulfonyl)- 4-Mesylbenzeneacetic acid 4-Methylsulphonylphenylacetic acid,95% 4-(Methylsulfonyl)ph 4-(Carboxymethyl)phenyl methyl sulphone Etoricoxib Related CoMpound B Etoricoxib impurity M 4-(Methylsulfonyl)phenylacetic acid 97% Etoricoxib USP Related Compound B 2-(4-methylsulfonylphenyl)acetate Etoricoxib?USP RC B Etoricoxib Intermediate 5 Etoricoxib Impurity 28 4-(Methylsulfonyl)phenylaceticAcid> OTHER BUILDING BLOCKS 4-(Methylsulfonyl)phenylacetic Acid (Int of Etoricoxib) Etocoxib impurity 2 90536-66-6 35230-23-1 C9H10O4S H3CSO2C6H4CH2CO2H Carboxylic acid Carboxylic Acids Chemical Synthesis Organic Building Blocks C9 Carbonyl Compounds Carboxylic Acids Building Blocks Carbonyl Compounds