1,1,2,2,3,3,4,4,4-nonafluoro-N-(2-hydroxyethyl)-1-Butanesulfonamide

Base Information

• Chemical Name: 1,1,2,2,3,3,4,4,4-nonafluoro-N-(2-hydroxyethyl)-1-Butanesulfonamide
• CAS No.: 34454-99-4
• Molecular Formula: C₆H₆F₉NO₃S
• Molecular Weight: 343.17
• European Community (EC) Number: 827-000-0
• DSSTox Substance ID: DTXSID00881351
• Wikidata: Q81987200
• Mol file: 34454-99-4.mol

Synonyms:34454-99-4;1,1,2,2,3,3,4,4,4-nonafluoro-N-(2-hydroxyethyl)-1-Butanesulfonamide;FBSE;1,1,2,2,3,3,4,4,4-Nonafluoro-N-(2-hydroxyethyl)butane-1-sulfonamide;1,1,2,2,3,3,4,4,4-nonafluoro-N-2-hydroxyethyl-butane-1-sulfonamide;SCHEMBL1070262;DTXSID00881351;ASJXVGSUYQIIBC-UHFFFAOYSA-N;AMY40848;Perfluorobutane-1-sulfonamidoethanol;2-(Perfluorobutanesulfonamido)ethanol;AKOS037621435;perfluorobutanesulfonamido ethanol, n =4;NS00010979;N-(2-Hydroxyethyl)perfluorobutane-1-sulfonamide;1,1,2,2,3,3,4,4,4-Nonafluoro-butane-1-sulfonic acid (2-hydroxy-ethyl)-amide

Chemical Property of 1,1,2,2,3,3,4,4,4-nonafluoro-N-(2-hydroxyethyl)-1-Butanesulfonamide

Chemical Property:

• Boiling Point: 238.5±50.0 °C(Predicted)
• Density: 1.680±0.06 g/cm3(Predicted)
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 13
• Rotatable Bond Count: 6
• Exact Mass: 342.99246769
• Heavy Atom Count: 20
• Complexity: 438

Purity/Quality:

99.3% ^*data from raw suppliers

1,1,2,2,3,3,4,4,4-Nonafluoro-N-(2-hydroxyethyl)-1-butanesulfonamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(CO)NS(=O)(=O)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
• Uses: 1,1,2,2,3,3,4,4,4-Nonafluoro-N-(2-hydroxyethyl)-1-butanesulfonamide is derived from Nonafluoro-1-butanesulfonyl Fluoride (N649320), which is a useful perfluorinated compound (PFC) used in organic synthesis.

Technology Process of 1,1,2,2,3,3,4,4,4-nonafluoro-N-(2-hydroxyethyl)-1-Butanesulfonamide

There total 2 articles about 1,1,2,2,3,3,4,4,4-nonafluoro-N-(2-hydroxyethyl)-1-Butanesulfonamide 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:

[1,3]-dioxolan-2-one (96-49-1) + perfluoro-n-butane sulfonamide (30334-69-1) → 1,1,2,2,3,3,4,4,4-Nonafluoro-butane-1-sulfonic acid (2-hydroxy-ethyl)-amide (34454-99-4)

Guidance literature:

With potassium hydroxide; at 200 ℃;

Reference yield:

→ 1,1,2,2,3,3,4,4,4-Nonafluoro-butane-1-sulfonic acid (2-hydroxy-ethyl)-amide (34454-99-4)

Guidance literature:

Sulfonamid, Propylencarbonat;

Reference yield: 90.0%

1,1,2,2,3,3,4,4,4-Nonafluoro-butane-1-sulfonic acid (2-hydroxy-ethyl)-amide (34454-99-4) + diphenylboronchloride (3677-81-4) → C4F9SO2N(B(C6H5)2)CH2CH2OB(C6H5)2 (74941-57-4)

Guidance literature:

In tetrachloromethane; byproducts: HCl; (N2); to soln. of sulfonamide was dropped soln. of boranederiv. (1:2 mol) and mixt. was refluxed for 12 h; solvent was removed and residue distd. in vac.; elem. anal.;

DOI:10.1016/S0022-328X(00)83053-3

upstream raw materials:

[1,3]-dioxolan-2-one

perfluoro-n-butane sulfonamide

Downstream raw materials:

C₄F₉SO₂N(B(C₆H₅)2)CH₂CH₂OB(C₆H₅)2

C₄F₉SO₂NCH₂CH₂OBC₆H₅