2-Ethoxyethyl benzenesulfonate

Base Information

• Chemical Name: 2-Ethoxyethyl benzenesulfonate
• CAS No.: 17178-09-5
• Molecular Formula: C₁₀H₁₄O₄S
• Molecular Weight: 230.285
• Hs Code.: 2909499000
• DSSTox Substance ID: DTXSID10938042
• Wikidata: Q82914289
• Mol file: 17178-09-5.mol

Synonyms:2-ETHOXYETHYL BENZENESULFONATE;17178-09-5;2-Ethoxyethanol benzenesulfonate;Ethanol, 2-ethoxy-, benzenesulfonate;DTXSID10938042

Chemical Property of 2-Ethoxyethyl benzenesulfonate

Chemical Property:

• PSA: 60.98000
• LogP: 2.50920
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 230.06128010
• Heavy Atom Count: 15
• Complexity: 249

Purity/Quality:

2-ETHOXYETHYL BENZENESULFONATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOCCOS(=O)(=O)C1=CC=CC=C1

Technology Process of 2-Ethoxyethyl benzenesulfonate

There total 2 articles about 2-Ethoxyethyl benzenesulfonate 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-ethoxy-ethanol (110-80-5) + benzenesulfonyl chloride (98-09-9) → 1-ethoxy-2-benzenesulfonyloxy-ethane (17178-09-5)

Guidance literature:

With sodium hydroxide;

DOI:10.1007/s004190000119

Reference yield:

→ 1-ethoxy-2-benzenesulfonyloxy-ethane (17178-09-5)

Guidance literature:

Ph-SO2Cl, /BRN= 98271/;

Reference yield:

1-ethoxy-2-benzenesulfonyloxy-ethane (17178-09-5) → 2-(2-ethoxy-ethyl)-2-(2,3-dimethoxy-phenyl)-heptanedinitrile (412315-04-9)

Guidance literature:

With diethyl ether; benzene;

DOI:10.1007/s004190000119

upstream raw materials:

2-ethoxy-ethanol

benzenesulfonyl chloride

Downstream raw materials:

1-(2-ethoxy-ethyl)-4-phenyl-piperazine

2-(2-ethoxy-ethyl)-2-(2,3-dimethoxy-phenyl)-heptanedinitrile