2,3,4,6-Tetraethylbenzenesulfonic acid

Base Information

• Chemical Name: 2,3,4,6-Tetraethylbenzenesulfonic acid
• CAS No.: 63877-65-6
• Molecular Formula: C₁₄H₂₂O₃S
• Molecular Weight: 270.393
• NSC Number: 143568
• DSSTox Substance ID: DTXSID90301457
• Wikidata: Q82045405
• Mol file: 63877-65-6.mol

Synonyms:63877-65-6;2,3,4,6-tetraethylbenzenesulfonic acid;NSC143568;DTXSID90301457;NSC-143568

Chemical Property of 2,3,4,6-Tetraethylbenzenesulfonic acid

Chemical Property:

• Density: 1.11g/cm³
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 270.12896573
• Heavy Atom Count: 18
• Complexity: 345

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC(=C(C(=C1CC)CC)S(=O)(=O)O)CC

Technology Process of 2,3,4,6-Tetraethylbenzenesulfonic acid

There total 2 articles about 2,3,4,6-Tetraethylbenzenesulfonic acid 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:

benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → 2,3,4,6-tetraethyl-benzenesulfonic acid (63877-65-6)

Guidance literature:

Multi-step reaction with 2 steps

1: AlCl₃

2: chlorosulfuric acid / Erwaermen des Reaktionsprodukts mit wss.Natronlauge

With aluminium trichloride; chlorosulphuric acid;

DOI:10.1021/ja01867a016

Reference yield:

1,2,3,5-tetraethylbenzene (38842-05-6) → 2,3,4,6-tetraethyl-benzenesulfonic acid (63877-65-6)

Guidance literature:

With chlorosulphuric acid; Erwaermen des Reaktionsprodukts mit wss.Natronlauge;

DOI:10.1021/ja01867a016

upstream raw materials:

1,2,3,5-tetraethylbenzene

benzene