2-(Ethylsulfonyl)ethanol

Base Information

• Chemical Name: 2-(Ethylsulfonyl)ethanol
• CAS No.: 513-12-2
• Molecular Formula: C4H10 O3 S
• Molecular Weight: 138.188
• Hs Code.: 2905590090
• European Community (EC) Number: 670-925-8
• NSC Number: 60543
• UNII: 95YYW1049K
• DSSTox Substance ID: DTXSID50199296
• Nikkaji Number: J6.278B
• Wikidata: Q27271826
• Mol file: 513-12-2.mol

Synonyms:2-(Ethylsulfonyl)ethanol;513-12-2;2-ethylsulfonylethanol;Ethylsulfonylethyl alcohol;ETHANOL, 2-(ETHYLSULFONYL)-;Ethylsulfonylethanol;Ethyl 2-hydroxyethyl sulfone;2-(ethanesulfonyl)ethanol;NSC 60543;BRN 1748754;2-hydroxyethyl ethyl sulfone;UNII-95YYW1049K;ESE;95YYW1049K;NSC-60543;beta-ethylsulfonylethanol;2-(Ethylsulfonyl)ethan-1-ol;WLN: WS2&2Q;2-(ethanesulfonyl)ethan-1-ol;SCHEMBL1149060;2-(Ethylsulfonyl)ethanol, Tech.;DTXSID50199296;NSC60543;Ethyl 2-hydroxyethyl sulfone, Tech.;MFCD00041259;STK505641;AKOS005172029;2-(ETHYLSULFONYL)ETHANOL [MI];LS-02992;LS-66784;CS-0315893;FT-0608801;A828531;Q27271826

Chemical Property of 2-(Ethylsulfonyl)ethanol

Chemical Property:

• Vapor Pressure: 1.01E-05mmHg at 25°C
• Melting Point: 37 °C
• Refractive Index: 1.4640 (estimate)
• Boiling Point: 153°C 2,5mm,332.9 °C at 760 mmHg
• PKA: 13.61±0.10(Predicted)
• Flash Point: 155.1 °C
• PSA: 62.75000
• Density: 1.221 g/cm³
• LogP: 0.49420
• Sensitive.: Hygroscopic
• XLogP3: -0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 138.03506535
• Heavy Atom Count: 8
• Complexity: 130

Purity/Quality:

99%, ^*data from raw suppliers

2-(Ethylsulfonyl)ethanol 95+% ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCS(=O)(=O)CCO
• Uses: Solvent and organic intermediate, antistatic agent, humectant.

Technology Process of 2-(Ethylsulfonyl)ethanol

There total 11 articles about 2-(Ethylsulfonyl)ethanol 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: 98.0%

2-(ethylsulfanyl)ethanol (110-77-0) → 2-ethanesulfonylethanol (513-12-2)

Guidance literature:

With lithium molybdate; dihydrogen peroxide; In methanol; water; at 40 ℃; Flow reactor;

DOI:10.1002/chem.201903505

Reference yield: 5.0%

sodium ethanesulfinate (20035-08-9) + 2-chloro-ethanol (107-07-3) → 2-ethanesulfonylethanol (513-12-2)

Guidance literature:

In ethanol; water; for 50h;

Reference yield: 1.0%

2-(ethylsulfanyl)ethanol (110-77-0) → 1-bromo-2-ethanesulfonyl-ethane (30129-83-0) + 2-ethanesulfonylethanol (513-12-2)

Guidance literature:

With hydrogen bromide; dihydrogen peroxide;

DOI:10.1007/BF00949956

upstream raw materials:

2-(ethylsulfanyl)ethanol

ethyl vinyl sulfone

1,2-bis-ethanesulfonyl-ethane

sodium 2-hydroxyethanesulfinate

Downstream raw materials:

ethyl vinyl sulfone

Phosphoric acid O,O-diethyl O-<2-(ethylsulfonyl)ethyl> ester

thiophosphoric acid O-(2-ethanesulfonyl-ethyl ester)-O',O''-diethyl ester

diethylsulfone

Refernces

• 1、 Kobayashi, Shū,Koumura, Nagatoshi,Masuda, Koichiro,Onozawa, Shun-Ya,Sato, Kazuhiko,Shimada, Shigeru,Wang, Yao. "Robust Organic Photosensitizers Immobilized on a Vinylimidazolium Functionalized Support for Singlet Oxygen Generation under Continuous-Flow Conditions". supporting information. p. 497 - 501. Retrieved 2020/03/13.
• 2、 Shi, Xianying,Ma, Wenjuan,Ou, Hui,Han, Xiaoyan,Lu, Congmin,Chen, Yan,Wei, Junfa. "A peroxotungstate-ionic liquid brush assembly: An efficient and reusable catalyst for selectively oxidizing sulfides with aqueous H2O 2 solution in neat water". . p. 1536 - 1542. Retrieved 2012/11/07.