4-propylbenzenesulfonic Acid

Base Information

• Chemical Name: 4-propylbenzenesulfonic Acid
• CAS No.: 15592-74-2
• Molecular Formula: C₉H₁₂O₃S
• Molecular Weight: 200.258
• DSSTox Substance ID: DTXSID20935325
• Nikkaji Number: J1.557.018K
• Wikidata: Q82911360
• Mol file: 15592-74-2.mol

Synonyms:4-propylbenzenesulfonic Acid;15592-74-2;p-propylbenzene sulfonic acid;SCHEMBL330904;4-Propylbenzene-1-sulfonic acid;DTXSID20935325;4-Propylbenzenesulfonic acid, AldrichCPR

Chemical Property of 4-propylbenzenesulfonic Acid

Chemical Property:

• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 200.05071541
• Heavy Atom Count: 13
• Complexity: 232

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCC1=CC=C(C=C1)S(=O)(=O)O

Technology Process of 4-propylbenzenesulfonic Acid

There total 3 articles about 4-propylbenzenesulfonic 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:

phenylpropane (103-65-1) → 4-propylbenzenesulfonic acid (15592-74-2)

Guidance literature:

With sulfuric acid;

Reference yield:

phenylpropane (103-65-1) → 4-propylbenzenesulfonic acid (15592-74-2)

Guidance literature:

With sulfuric acid;

Reference yield:

bromobenzene (108-86-1,52753-63-6) → 4-propylbenzenesulfonic acid (15592-74-2)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium; diethyl ether

2: sulfuric acid

With diethyl ether; sulfuric acid; sodium;

upstream raw materials:

phenylpropane

bromobenzene

Downstream raw materials:

4-n-Propylphenol

Refernces