1-Octanesulfonyl fluoride

Base Information

Chemical Name:1-Octanesulfonyl fluoride
CAS No.:40630-63-5
Molecular Formula:C8H17FO2S
Molecular Weight:196.286
Hs Code.:2904909090
European Community (EC) Number:255-012-0
UNII:8G6E848M0E
DSSTox Substance ID:DTXSID3028009
Nikkaji Number:J23.346C
Wikidata:Q15478884
ChEMBL ID:CHEMBL499569
Mol file:40630-63-5.mol

Synonyms:octane-1-sulfonyl fluoride;1-Octanesulfonyl fluoride;40630-63-5;octanesulfonyl fluoride;1-Octanesulphonyl fluoride;EINECS 255-012-0;UNII-8G6E848M0E;CHEMBL499569;8G6E848M0E;n-octane-sulfonyl fluoride;N-octanesulfonylfluoride;n-octane-sulfonylfluoride;D04YUA;C8H17FO2S;SCHEMBL678663;DTXSID3028009;C8-H17-F-O2-S;BDBM50247008;LS-97938;EN300-1451266;Q15478884

Suppliers and Price of 1-Octanesulfonyl fluoride

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 9 raw suppliers

Chemical Property of 1-Octanesulfonyl fluoride

Chemical Property:

Vapor Pressure:0.0221mmHg at 25°C
Boiling Point:258.5°C at 760 mmHg
Flash Point:110.1°C
PSA：42.52000
Density:1.049g/cm³
LogP:3.72700
XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:196.09332912
Heavy Atom Count:12
Complexity:182

Purity/Quality:: 99.3% ^*data from raw suppliers

Safty Information:

Pictogram(s): A mild skin and eye irritant.
Hazard Codes:A mild skin and eye irritant.

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCS(=O)(=O)F

Technology Process of 1-Octanesulfonyl fluoride

There total 5 articles about 1-Octanesulfonyl fluoride 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: 95.0%

: 122-20-3
triisopropanolamine

: 7795-95-1
octane-1-sulfonyl chloride

: 40630-63-5
octanesulfonyl fluoride

Guidance literature:: With potassium fluoride; In water;

Reference yield: 82.0%

: 1065131-41-0
n-octanesulfonyl hydrazide

: 40630-63-5
octanesulfonyl fluoride

Guidance literature:: With Selectfluor; In water; at 60 ℃; for 14h; Schlenk technique;
DOI:10.1039/c5gc02755a

Reference yield: 69.0%

: 111-83-1
1-bromo-octane

: 40630-63-5
octanesulfonyl fluoride

Guidance literature:: 1-bromo-octane; With iodine; magnesium; In tetrahydrofuran; Inert atmosphere; Sealed tube; Reflux;

With fluorosulfonyl fluoride; In tetrahydrofuran; at 23 ℃; for 1h; Inert atmosphere;
DOI:10.1039/c9cc08487h