1,2,2,3,3,4,5,5,6,6-decafluoro-4-(1,1,2,2,2-pentafluoroethyl)cyclohexane-1-sulfonic Acid

Base Information

• Chemical Name: 1,2,2,3,3,4,5,5,6,6-decafluoro-4-(1,1,2,2,2-pentafluoroethyl)cyclohexane-1-sulfonic Acid
• CAS No.: 646-83-3
• Molecular Formula: C8H F15 O3 S
• Molecular Weight: 462.136
• Hs Code.: 2904909090
• DSSTox Substance ID: DTXSID70275965
• Mol file: 646-83-3.mol

Synonyms:perfluoroethylcyclohexane sulfonate;perfluoroethylcyclohexanesulfonate;perfluoroethylcyclohexanesulfonic acid;PFECHS cpd

Chemical Property of 1,2,2,3,3,4,5,5,6,6-decafluoro-4-(1,1,2,2,2-pentafluoroethyl)cyclohexane-1-sulfonic Acid

Chemical Property:

• PSA: 49.33000
• LogP: -0.09740
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 2
• Exact Mass: 461.9406875
• Heavy Atom Count: 27
• Complexity: 701

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: PFAS
• Canonical SMILES: C1(C(C(C(C(C1(F)F)(F)F)(F)S(=O)(=O)O)(F)F)(F)F)(C(C(F)(F)F)(F)F)F

Technology Process of 1,2,2,3,3,4,5,5,6,6-decafluoro-4-(1,1,2,2,2-pentafluoroethyl)cyclohexane-1-sulfonic Acid

There total 1 articles about 1,2,2,3,3,4,5,5,6,6-decafluoro-4-(1,1,2,2,2-pentafluoroethyl)cyclohexane-1-sulfonic 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:

perfluoro-4-ethylcyclohexanesulfonylfluoride (80308-98-1) → perfluoro(4-ethylcyclohexane)sulfonic acid (646-83-3)

Guidance literature:

Reference yield:

perfluoro(4-ethylcyclohexane)sulfonic acid (646-83-3) + potassium hydroxide → potassium 4-(pentafluoroethyl)perfluorocyclohexanesulfonate (335-24-0)

Guidance literature:

Reference yield:

perfluoro(4-ethylcyclohexane)sulfonic acid (646-83-3) → perfluoro(4-ethylcyclohexane)sulfonic acid anhydride (2821-13-8)

Guidance literature:

With phosphorus pentachloride; at 225 ℃;

DOI:10.1021/jo01040a019

upstream raw materials:

perfluoro-4-ethylcyclohexanesulfonylfluoride

Downstream raw materials:

perfluoro(4-ethylcyclohexane)sulfonic acid anhydride

potassium 4-(pentafluoroethyl)perfluorocyclohexanesulfonate