ChemicalBook >> CAS DataBase List >>4-Methylthiophenylacetic acid

4-Methylthiophenylacetic acid

CAS No.
16188-55-9
Chemical Name:
4-Methylthiophenylacetic acid
Synonyms
RARECHEM AL BO 0923;4-Methylthiophenylac;Etoricoxib Impurity 53;4-(Methylthio)fenylazijnzuur;4-(methylthio)ohenylacetic acid;4-(METHYLTHIO)PHENYLACETIC ACID;4-(Methylthio)benzeneacetic acid;4-(Methylthio)phenylacetic acid,98%;4-(Methylthio)phenylacetic acid 99%;2-(4-(methylthio)phenyl)acetic acid
CBNumber:
CB5145142
Molecular Formula:
C9H10O2S
Molecular Weight:
182.24
MDL Number:
MFCD00192325
MOL File:
16188-55-9.mol
MSDS File:
SDS
Last updated:2025-08-08 17:45:00
Product description Number Pack Size Price
4-(Methylthio)phenylacetic acid 99% 396591 1g $60.7
4-(Methylthio)phenylacetic Acid >98.0%(GC)(T) M2874 1g $48
4-(Methylthio)phenylacetic Acid >98.0%(GC)(T) M2874 5g $152
4-(Methylthio)phenylacetic Acid M725578 50mg $60
4-(Methylthio)phenylacetic Acid D365 5g $41
More product size

4-Methylthiophenylacetic acid Properties

Melting point 97-98 °C(lit.)
Boiling point 337.4±25.0 °C(Predicted)
Density 1.23±0.1 g/cm3(Predicted)
storage temp. 2-8°C
form powder to crystal
pka 4.34±0.10(Predicted)
color White to Yellow to Orange
InChI InChI=1S/C9H10O2S/c1-12-8-4-2-7(3-5-8)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChIKey AHMLFHMRRBJCRM-UHFFFAOYSA-N
SMILES C1(CC(O)=O)=CC=C(SC)C=C1
CAS DataBase Reference 16188-55-9(CAS DataBase Reference)
UNSPSC Code 12352100
NACRES NA.22

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26-36
WGK Germany  3
HS Code  29309099
NFPA 704
1
2 0

4-Methylthiophenylacetic acid price More Price(31)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 396591 4-(Methylthio)phenylacetic acid 99% 16188-55-9 1g $60.7 2025-07-31 Buy
TCI Chemical M2874 4-(Methylthio)phenylacetic Acid >98.0%(GC)(T) 16188-55-9 1g $48 2025-07-31 Buy
TCI Chemical M2874 4-(Methylthio)phenylacetic Acid >98.0%(GC)(T) 16188-55-9 5g $152 2025-07-31 Buy
TRC M725578 4-(Methylthio)phenylacetic Acid 16188-55-9 50mg $60 2021-12-16 Buy
AK Scientific D365 4-(Methylthio)phenylacetic Acid 16188-55-9 5g $41 2021-12-16 Buy
Product number Packaging Price Buy
396591 1g $60.7 Buy
M2874 1g $48 Buy
M2874 5g $152 Buy
M725578 50mg $60 Buy
D365 5g $41 Buy

4-Methylthiophenylacetic acid Chemical Properties,Uses,Production

Chemical Properties

Cream crystalline powder

General Description

TiO2 photocatalytic one-electron oxidation of 4-(methylthio)phenylacetic acid has been reported by time-resolved diffuse reflectance spectroscopy.

Synthesis

4-Chlorophenylacetic acid

1878-66-6

Sodium thiomethoxide

5188-07-8

4-Methylthiophenylacetic acid

16188-55-9

1. 10 g of 4-bromophenylacetic acid was dissolved in 20 mL of DMF under nitrogen protection. 2. 5.0 g of sodium methanethiol and 0.5 g of copper powder were added for nitrogen displacement. 3. The reaction mixture was heated to 130 °C under nitrogen protection and the reaction was stirred for 24 hours. 4. After the reaction was completed, it was cooled to room temperature. 5. The reaction mixture was processed according to the method of Example 1 to finally obtain 4-methylthiophenylacetic acid in 79.3% yield. Alternative steps: 1. 10 g of 4-bromophenylacetic acid was dissolved in 20 mL of DMF under nitrogen protection. 2. 5.0 g of sodium methanethiol and 0.1 g of cuprous bromide were added for nitrogen substitution. 3. The reaction mixture was heated to 130 °C under nitrogen protection and the reaction was stirred for 4 hours. 4. Upon completion of the reaction, the mixture was cooled to room temperature, 5mL of 40% NaOH solution was added and stirred for 10 minutes. 5. Extracted twice with 25mL of ethyl acetate and combined the organic phases. 6. Add 50mL of ethyl acetate and adjust pH to 2-4 with 10% dilute sulfuric acid. 7. Collect the ethyl acetate layer and wash with 10mL of water. 8. Concentrate ethyl acetate to about 20mL by distillation, add 20mL hexane. 9. Heat to reflux to completely dissolve the solid, slowly cool to room temperature and filter to obtain yellow crystals. 10. 6.38g of 4-methylthiophenylacetic acid was obtained after drying in 76.1% yield.

References

[1] Patent: CN105646306, 2016, A. Location in patent: Paragraph 0011

4-Methylthiophenylacetic acid Preparation Products And Raw materials

Global( 210)Suppliers
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View Lastest Price from 4-Methylthiophenylacetic acid manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
4-Methylthiophenylacetic acid pictures 2025-07-25 4-Methylthiophenylacetic acid
16188-55-9
US $0.00 / kg 1kg 99% 10000KGS Shaanxi Dideu New Materials Co. Ltd
4-Methylthiophenylacetic acid pictures 2025-04-04 4-Methylthiophenylacetic acid
16188-55-9
US $0.00-0.00 / kg 1kg 98% 1Ton Henan Aochuang Chemical Co.,Ltd.
4-Methylthiophenylacetic acid pictures 2019-07-14 4-Methylthiophenylacetic acid
16188-55-9
US $8.80 / KG 1KG 97%-99% 100kg Career Henan Chemical Co
4-(METHYLTHIO)PHENYLACETIC ACID RARECHEM AL BO 0923 (4-METHYLSULFANYL-PHENYL)-ACETIC ACID 2-(4-(methylthio)phenyl)acetic acid 4-(Methylthio)benzeneacetic acid 4-(Methylthio)phenylacetic acid,98% 4-Methylthiophenylac 2-[4-(Methylsulfanyl)phenyl]acetic acid 4-(Methylthio)phenylacetic acid 99% 4-(Methylthio)fenylazijnzuur 4-(methylthio)ohenylacetic acid JR-13703, 2-(4-(Methylthio)phenyl)acetic acid, 98% Etoricoxib Impurity 53 Benzeneacetic acid, 4-(methylthio)- 2-(4-methylsulfanylphenyl)aceticaci 16188-55-9 16288-55-9 16188-55-6 CARBOXYLIC ACID Organic Building Blocks Carbonyl Compounds Carboxylic Acids C9 Building Blocks Building Blocks Carbonyl Compounds Carboxylic Acids Chemical Synthesis Organic Building Blocks C9 Carbonyl Compounds Carboxylic Acids