1H,1H,9H-Perfluorononyl p-toluenesulfonate

Base Information

• Chemical Name: 1H,1H,9H-Perfluorononyl p-toluenesulfonate
• CAS No.: 864-23-3
• Molecular Formula: C16H10 F16 O3 S
• Molecular Weight: 586.29
• Hs Code.: 2905590090
• DSSTox Substance ID: DTXSID10379936
• Wikidata: Q82169961
• Mol file: 864-23-3.mol

Synonyms:1H,1H,9H-Perfluorononyl p-toluenesulfonate;864-23-3;2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorononyl 4-methylbenzenesulfonate;1H,1H,9H-Perfluorononyl 4-toluene sulfonate;1H,1H,9H-PERFLUORONONYLP-TOLUENESULFONATE;1H,1H,9H-Perfluorononyl (4-methylphenyl)sulphonate;DTXSID10379936;MFCD00085895;AKOS024319099;CS-0456587;FT-0676217;A841640;2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-HEXADECAFLUORONONYL PARA-TOLUENESULFONATE;2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecakis(fluoranyl)nonyl 4-methylbenzenesulfonate;4-methylbenzenesulfonic acid 2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-hexadecafluorononyl ester

Chemical Property of 1H,1H,9H-Perfluorononyl p-toluenesulfonate

Chemical Property:

• Vapor Pressure: 7.06E-06mmHg at 25°C
• Melting Point: 46.5
• Refractive Index: 1.374
• Boiling Point: 171.5/2.3mm
• Flash Point: 188.5°C
• PSA: 51.75000
• Density: 1.568g/cm³
• LogP: 7.49330
• XLogP3: 7.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 19
• Rotatable Bond Count: 11
• Exact Mass: 586.0095159
• Heavy Atom Count: 36
• Complexity: 872

Purity/Quality:

97% ^*data from raw suppliers

1H,1H,9H-Perfluorononylp-Toluenesulfonate ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC(C(C(C(C(C(C(C(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• Uses: 1H,1H,9H-Perfluorononyl p-toluenesulfonate is a perfluoroalkylating agent which is also used in the synthesis of polyfluoroalkylamines.

Technology Process of 1H,1H,9H-Perfluorononyl p-toluenesulfonate

There total 1 articles about 1H,1H,9H-Perfluorononyl p-toluenesulfonate 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: 82.0%

1H,1H,9H-hexadecafluoro-1-nonanol (376-18-1) + p-toluenesulfonyl chloride (98-59-9) → 1H,1H,9H-Hexadecafluor-nonyl-p-tosylat (864-23-3)

Guidance literature:

With potassium hydroxide; In benzene; at 80 ℃; for 1h;

upstream raw materials:

1H,1H,9H-hexadecafluoro-1-nonanol

p-toluenesulfonyl chloride