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4337-33-1

Basic Information
CAS No.: 4337-33-1
Name: (2-Carboxyethyl)dimethylsulfonium Chloride
Article Data: 8
Molecular Structure:
Molecular Structure of 4337-33-1 ((2-Carboxyethyl)dimethylsulfonium Chloride)
Formula: C5H11ClO2S
Molecular Weight: 170.66
Synonyms: Sulfonium, (2-carboxyethyl)dimethyl-, chloride (8CI,9CI);(2-Carboxyethyl)dimethylsulfoniumchloride (6CI,7CI);Dimethyl-b-propiothetin chloride;Dimethyl-b-propiothetin hydrochloride;b-Propiothetin, dimethyl-,hydrochloride;
EINECS: 201-081-7
Melting Point: 129 °C
Hazard Symbols: Xi
PSA: 62.60000
LogP: -2.65700
Synthetic route
107-94-8

chloropropionic acid

75-18-3

dimethylsulfide

4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

Conditions
ConditionsYield
In acetonitrile at 20℃; for 168h; Solvent;59.71%
In acetone at 40 - 50℃; for 20h; Solvent;156.5 g
57-57-8

β-Propiolactone

75-18-3

dimethylsulfide

75-52-5

nitromethane

4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

Conditions
ConditionsYield
anschl. mit HCl;
57-57-8

β-Propiolactone

75-18-3

dimethylsulfide

75-05-8

acetonitrile

4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

Conditions
ConditionsYield
anschl. mit HCl;
75-18-3

dimethylsulfide

79-10-7

acrylic acid

4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

Conditions
ConditionsYield
With hydrogenchloride In acetone at 0 - 20℃;
With hydrogenchloride In dichloromethane at -80 - 20℃; for 0.5h; Michael Addition;
75-18-3

dimethylsulfide

1259387-79-5

3-(methanesulfonyloxy)propionic acid

4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

Conditions
ConditionsYield
Stage #1: dimethylsulfide; 3-(methanesulfonyloxy)propionic acid In toluene at 20℃; for 4h;
Stage #2: With hydrogenchloride In water; toluene at 20℃; for 1h; Temperature;
72.3 g
74-87-3

methylene chloride

646-01-5

3-(methylsulfanyl)propionic acid

4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

Conditions
ConditionsYield
In ethyl acetate at 2℃; for 4.25h; Time;135.9 g
56-23-5

tetrachloromethane

4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

75-18-3

dimethylsulfide

4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

75-18-3

dimethylsulfide

4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

950816-92-9

1-hydroxy-3-(dimethylsulfonium-1-yl)propylidene-1,1-bisphosphonic acid

Conditions
ConditionsYield
With phosphoric acid; pyridine hydrochloride; phosphorus trichloride at 70℃; for 4h;172 mg
4337-33-1

(2‐carboxyethyl)dimethylsulfonium chloride

7314-30-9

3-(dimethylsulfonio)propionate

Conditions
ConditionsYield
With sodium hydrogencarbonate In water at 0℃; Reagent/catalyst;80 g
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    4337-33-1

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  • (2-CARBOXYETHYL)DIMETHYLSULFONIUMCHLORIDE CAS No.4337-33-1

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    4337-33-1

    (2-CARBOXYETHYL)DIMETHYLSULFONIUMCHLORIDE CAS No.4337-33-1

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  • (2-Carboxyethyl)dimethylsulfonium Chloride

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    4337-33-1

    (2-Carboxyethyl)dimethylsulfonium Chloride

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Specification

The Sulfonium,(2-carboxyethyl)dimethyl-, chloride (1:1), with the CAS registry number 4337-33-1, is also known as (2-Carboxyethyl)(dimethyl)sulfonium chloride. It belongs to the product categories of Iodonium Sulfonium & Oxonium Compounds; Sulfonium Compounds. This chemical's molecular formula is C5H11ClO2S and molecular weight is 170.66. What's more, its IUPAC name is called 2-Carboxyethyl(dimethyl)sulfanium chloride. It should be kept in a cold, airtight and dry place.

Physical properties about Sulfonium,(2-carboxyethyl)dimethyl-, chloride (1:1) are: (1) #H bond acceptors: 2; (2) #H bond donors: 1; (3) #Freely Rotating Bonds: 3; (4) Polar Surface Area: 26.3 Å2; (5) Melting Point: 129 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: [Cl-].O=C(O)CC[S+](C)C
(2) InChI: InChI=1/C5H10O2S.ClH/c1-8(2)4-3-5(6)7;/h3-4H2,1-2H3;1H
(3) InChIKey: RRUMKKGRKSSZKY-UHFFFAOYAN