Dimethylpropiothetin

Base Information

• Chemical Name: Dimethylpropiothetin
• CAS No.: 7314-30-9
• Deprecated CAS: 6708-36-7,83532-43-8
• Molecular Formula: C5H10O2S
• Molecular Weight: 134.20
• Hs Code.: 2942000000
• European Community (EC) Number: 802-067-9
• UNII: C884XA7QGG
• DSSTox Substance ID: DTXSID0041014
• Wikipedia: Dimethylsulfoniopropionate
• Wikidata: Q3817447
• Metabolomics Workbench ID: 50508
• Mol file: 7314-30-9.mol

Synonyms:(2-carboxyethyl)dimethylsulfonium chloride;3-dimethylsulfoniopropionate;beta-dimethylsulfoniopropionate;beta-DMSP;dimethyl-beta-propiothetin;dimethyl-beta-propiothetin chloride;dimethyl-propiothetin;dimethylpropiothetin;dimethylpropiothetin chloride;dimethylpropiothetin hydrochloride;dimethylsulfoniopropionate;dimethylsulfoniopropionate chloride;DMPT;S,S-dimethyl-beta-propiothetin;S-dimethylsulfonium propionic acid;sulfonium, (2-carboxyethyl)dimethyl-, chloride (1:1)

Chemical Property of Dimethylpropiothetin

Chemical Property:

• PSA: 65.43000
• LogP: -0.99570
• Storage Temp.: Hygroscopic, Refrigerator, under inert atmosphere
• Solubility.: Methanol, Water
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 134.04015073
• Heavy Atom Count: 8
• Complexity: 75

Purity/Quality:

98%,99%, ^*data from raw suppliers

Dimethylsulfonioproprionate(contains~20%water) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[S+](C)CCC(=O)[O-]
• Uses: Dimethylsulfonioproprionate is a metabolite produced primarily by marine phytoplankton and is the main precursor to the climatically important gas dimethylsulfide (DMS). Dimethylsulfonioproprionate along with DMS is a primary source of sulfur aerosol in the earth’s atmosphere and may have an influence on global temperature.

Technology Process of Dimethylpropiothetin

There total 2 articles about Dimethylpropiothetin which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

(2‐carboxyethyl)dimethylsulfonium chloride (4337-33-1) → dimethylsulfoniopropionate (7314-30-9,6708-36-7)

Guidance literature:

With sodium hydrogencarbonate; In water; at 0 ℃; Reagent/catalyst;

Reference yield:

dimethylsulfoniopropionate (7314-30-9,6708-36-7) → C5H10O2S(1-) (7314-30-9)

Guidance literature:

With e^1-_aq; Rate constant; Ambient temperature; diff. pH;

Reference yield:

dimethylsulfoniopropionate (7314-30-9,6708-36-7) → C5H10O2S(1-) (7314-30-9)

Guidance literature:

With e^1-_aq; Rate constant; Ambient temperature; diff. pH;

upstream raw materials:

(2‐carboxyethyl)dimethylsulfonium chloride

dimethylsulfoniopropionate

Downstream raw materials:

dimethylsulfoniopropionate picrate

Refernces

• 1、 Bonifacic, Marija,Anklam, Elke. "One-electron Reduction of Sulphonium Salts in Aqueous Solution: a Pulse Radiolysis Study". . p. 243 - 248. Retrieved 2007/10/02.