3-(METHYLSULFONYL)PROPANOIC ACID
Application- Product Name
- 3-(METHYLSULFONYL)PROPANOIC ACID
- CAS No.
- 645-83-0
- Chemical Name
- 3-(METHYLSULFONYL)PROPANOIC ACID
- Synonyms
- 3-mesylpropionic acid;Methylsulfonyl propionic acid;3-methanesulfonylpropanoic acid;3-methanesulfonyl-propionic acid;3-(Methylsulfonyl)propionic acid;3-(METHYLSULFONYL)PROPANOIC ACID;Propionic acid, 3-(methylsulfonyl)-;Propanoic acid, 3-(methylsulfonyl)-
- CBNumber
- CB01496550
- Molecular Formula
- C4H8O4S
- Formula Weight
- 152.17
- MOL File
- 645-83-0.mol
3-(METHYLSULFONYL)PROPANOIC ACID Property
- Melting point:
- 102-105℃
- Boiling point:
- 409.0±28.0 °C(Predicted)
- Density
- 1.380
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 3.80±0.10(Predicted)
- Appearance
- White to off-white Solid
- InChI
- InChI=1S/C4H8O4S/c1-9(7,8)3-2-4(5)6/h2-3H2,1H3,(H,5,6)
- InChIKey
- ODUCCTTZGHSNKX-UHFFFAOYSA-N
- SMILES
- C(O)(=O)CCS(C)(=O)=O
- CAS DataBase Reference
- 645-83-0
Safety
- HazardClass
- IRRITANT
N-Bromosuccinimide Price
- Product number
- M339135
- Product name
- 3-(Methylsulfonyl)propanoicAcid
- Packaging
- 500mg
- Price
- $175
- Updated
- 2021/12/16
- Product number
- 065490
- Product name
- 3-(Methylsulfonyl)propanoic acid
- Packaging
- 500mg
- Price
- $85
- Updated
- 2021/12/16
- Product number
- 065490
- Product name
- 3-(Methylsulfonyl)propanoic acid
- Packaging
- 1g
- Price
- $150
- Updated
- 2021/12/16
- Product number
- 065490
- Product name
- 3-(Methylsulfonyl)propanoic acid
- Packaging
- 5g
- Price
- $455
- Updated
- 2021/12/16
- Product number
- CHM0109747
- Product name
- 3-(METHYLSULFONYL)PROPANOIC ACID
- Purity
- 95.00%
- Packaging
- 1G
- Price
- $794.34
- Updated
- 2021/12/16
3-(METHYLSULFONYL)PROPANOIC ACID Chemical Properties,Usage,Production
Application
3-(methanesulfonyl)propionic acid is an organic intermediate that can be obtained by oxidizing 3-(methylthio)propionic acid. The oxidizing agent can be hydrogen peroxide or potassium persulfate.
Synthesis
646-01-5
645-83-0
To a 250 mL round bottom flask was added 3-(methylthio)propionic acid (14.29 g, 118.9 mmol) followed by 57 mL of acetic anhydride and 57 mL of acetic acid. The reaction mixture was cooled in an ice bath and stirred continuously for 30 min. Then, 36 mL of 30% aqueous hydrogen peroxide solution was added dropwise at 15-minute intervals (50 mL total) using a syringe in 5 mL amounts at a time. The progress of the reaction was monitored by nuclear magnetic resonance (NMR), and after confirming the completion of the reaction, a small amount of manganese dioxide (MnO2) was added to quench the excess hydrogen peroxide, and stirring was continued for 2 hours. The reaction mixture was filtered through a diatomaceous earth pad and the filtrate was used to remove the organic solvent using a rotary evaporator. The residue was placed in a vacuum oven for 24 h to give 3-(methylsulfonyl)propionic acid (18.05 g, 99% yield) as a white solid. Melting point: 100-102 °C. 1H NMR (DMSO-d6, 400 MHz) δ: 12.59 (br s, 1H), 3.33 (t, J = 7.2 Hz, 2H), 2.99 (s, 3H), 2.68 (t, J = 7.2 Hz, 2H).13C NMR (DMSO-d6, 100 MHz) δ: 172.72, 50.35, 41.15, 28.03. High resolution mass spectrometry (HRMS-ESI) m/z: [M + Na]+ Calculated value 175.0036, measured value 175.0035.
References
[1] Bioorganic and Medicinal Chemistry, 2011, vol. 19, # 17, p. 5093 - 5102
[2] Biochemistry, 2017, vol. 56, # 2, p. 421 - 440
[3] Patent: EP3124482, 2017, A1. Location in patent: Paragraph 0695; 0696
[4] Patent: WO2016/50356, 2016, A1. Location in patent: Page/Page column 86; 87
[5] Patent: WO2014/144100, 2014, A2. Location in patent: Paragraph 00274
3-(METHYLSULFONYL)PROPANOIC ACID Preparation Products And Raw materials
Raw materials
Preparation Products
3-(METHYLSULFONYL)PROPANOIC ACID Suppliers
- Tel
- 0519-85170101
- Fax
- 0519-85170505
- sales@mingchem.com
- Country
- China
- ProdList
- 608
- Advantage
- 55
- Tel
- 13540909846 13882008651
- 3848291069@qq.com
- Country
- China
- ProdList
- 3001
- Advantage
- 58
- Tel
- 021-50795510 4000665055
- Fax
- 021-50795055
- sales@accelachem.com
- Country
- China
- ProdList
- 11035
- Advantage
- 64
- Tel
- 025-83697070
- Fax
- +86-25-83453306
- info@chemlin.com.cn
- Country
- China
- ProdList
- 15883
- Advantage
- 64
- Tel
- 0519-89185693 15312551983
- Fax
- 0519-89185693
- 2410037592@qq.com
- Country
- China
- ProdList
- 261
- Advantage
- 55
- Tel
- +86 21 61551611
- Fax
- +86 21 50676805
- Country
- China
- ProdList
- 9891
- Advantage
- 58
- Tel
- +86 0510-85629785
- Fax
- +86 0510-85625359
- Country
- China
- ProdList
- 2327
- Advantage
- 58
- Tel
- 400-164-7117 13681763483
- Fax
- +86-21-61629029
- product02@bidepharm.com
- Country
- China
- ProdList
- 42446
- Advantage
- 60
- Tel
- 0510-85629785 18013409632
- Fax
- 051085625359
- sales@reading-chemicals.com
- Country
- China
- ProdList
- 15178
- Advantage
- 58
- Tel
- 021-24206007 13764915196
- Fax
- 86-021-23027023
- sales@balmxy.com
- Country
- China
- ProdList
- 6874
- Advantage
- 55
View Lastest Price from 3-(METHYLSULFONYL)PROPANOIC ACID manufacturers
- Product
- 3-(METHYLSULFONYL)PROPANOIC ACID 645-83-0
- Price
- US $1.00/kg
- Min. Order
- 1kg
- Purity
- 99%
- Supply Ability
- 10 mt
- Release date
- 2024-11-13
- Product
- 3-(METHYLSULFONYL)PROPANOIC ACID 645-83-0
- Price
- US $1.00/KG
- Min. Order
- 1KG
- Purity
- 98%
- Supply Ability
- 10 tons
- Release date
- 2020-01-10