Propionic acid, 3,3'-sulfonyldi-

Base Information

• Chemical Name: Propionic acid, 3,3'-sulfonyldi-
• CAS No.: 6291-88-9
• Molecular Formula: C6H10 O6 S
• Molecular Weight: 210.208
• Hs Code.: 2915900090
• European Community (EC) Number: 228-546-7
• NSC Number: 8167
• DSSTox Substance ID: DTXSID60212102
• Nikkaji Number: J32.967C
• Wikidata: Q83087136
• ChEMBL ID: CHEMBL498855
• Mol file: 6291-88-9.mol

Synonyms:Propionic acid, 3,3'-sulfonyldi-;6291-88-9;3,3'-Sulfonyldipropionic acid;3-(2-carboxyethylsulfonyl)propanoic acid;3,3'-sulfonyldipropanoic acid;3,3'-Sulphonyldipropionic acid;Propanoic acid, 3,3'-sulfonylbis-;NSC 8167;EINECS 228-546-7;BRN 1789192;4-03-00-00735 (Beilstein Handbook Reference);sulfonyldipropionic acid;3-(2-Carboxy-ethanesulfonyl)-propionic acid;CHEMBL498855;SCHEMBL4413341;DTXSID60212102;NSC8167;C6-H10-O6-S;NSC-8167;AKOS000519744;beta, beta' - Sulfonyldipropionic acid;CCG-115200;NCGC00321472-01;LS-124854;AB00627521-03;3-(2-CARBOXYETHANESULFONYL)PROPANOIC ACID

Chemical Property of Propionic acid, 3,3'-sulfonyldi-

Chemical Property:

• Boiling Point: 567oC at 760 mmHg
• Flash Point: 296.7oC
• PSA: 117.12000
• Density: 1.524g/cm3
• LogP: 0.43140
• XLogP3: -1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 210.01980921
• Heavy Atom Count: 13
• Complexity: 261

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CS(=O)(=O)CCC(=O)O)C(=O)O

Technology Process of Propionic acid, 3,3'-sulfonyldi-

There total 9 articles about Propionic acid, 3,3'-sulfonyldi- 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: 82.0%

4-thiaheptane-1,7-dioic acid (111-17-1) → 3,3'-sulfonyldipropanoic acid (6291-88-9)

Guidance literature:

With dihydrogen peroxide; In methanol; at 40 ℃; for 1h; chemoselective reaction;

DOI:10.1039/c4ra06132b

Reference yield:

3,3'-sulfinyldipropionic acid (3680-08-8) → 3,3'-sulfonyldipropanoic acid (6291-88-9)

Guidance literature:

With sodium tungstate; oxygen; cathodic oxidation with polycrystalline graphite cathode, platinum anode; electrolyte KH₂PO₄, pH adjusted by 5 M HCl;

DOI:10.1246/cl.1997.387

Reference yield:

β-Propiolactone (57-57-8) → 3,3'-sulfonyldipropanoic acid (6291-88-9)

Guidance literature:

With sodium dithionite; water; acetone; und Erhitzen der mit wss.Salzsaeure angesaeuerten Reaktionsloesung;

DOI:10.1021/ja01125a054

upstream raw materials:

4-thiaheptane-1,7-dioic acid

β-Propiolactone

4,4-dioxo-4λ⁶-thia-heptanedinitrile

3,3'-sulfinyldipropionic acid

Downstream raw materials:

Bis-(2-methoxycarbonyl-ethyl)-sulfon

disodium 3-sulfinopropanoate

4,4-dioxo-4λ⁶-thia-heptanedioic acid diethyl ester

Refernces

• 1、 Boschmann, Erwin,Miller, Roger D.. "Influence of sulfur groups on carboxylic acid strengths". . p. 2617 - 2619. Retrieved 2018/04/30.
• 2、 Maleki, Behrooz,Hemmati, Saba,Sedrpoushan, Alireza,Ashrafi, Samaneh Sedigh,Veisi, Hojat. "Selective synthesis of sulfoxides and sulfones from sulfides using silica bromide as the heterogeneous promoter and hydrogen peroxide as the terminal oxidant". . p. 40505 - 40510. Retrieved 2015/02/03.