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1-Octanesulfonyl Chloride

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1-Octanesulfonyl Chloride Basic information
Product Name:1-Octanesulfonyl Chloride
Synonyms:OCTANESULFONYL CHLORIDE;N-OCTYLSULFONYL CHLORIDE;1-OCTANESULFONYL CHLORIDE;1-OCTANESULPHONYL CHLORIDE;1-Octanesulfonylchloride,97%;n-Octane sulfonyl chloride;1-octylsulfonyl chloride;OCTYLSULFONYLCHLORIDE
CAS:7795-95-1
MF:C8H17ClO2S
MW:212.74
EINECS:232-249-8
Product Categories:Organic Building Blocks;Sulfonyl Halides;Sulfur Compounds
Mol File:7795-95-1.mol
1-Octanesulfonyl Chloride Structure
1-Octanesulfonyl Chloride Chemical Properties
Melting point 14℃
Boiling point 75 °C/0.03 mmHg (lit.)
density 1.087 g/mL at 25 °C (lit.)
refractive index n20/D 1.460(lit.)
Fp >230 °F
storage temp. under inert gas (nitrogen or Argon) at 2-8°C
form clear liquid
color Colorless to Light red to Green
Sensitive Moisture Sensitive
BRN 1763921
InChIInChI=1S/C8H17ClO2S/c1-2-3-4-5-6-7-8-12(9,10)11/h2-8H2,1H3
InChIKeyWIVNTNLDTMNDNO-UHFFFAOYSA-N
SMILESC(S(Cl)(=O)=O)CCCCCCC
CAS DataBase Reference7795-95-1(CAS DataBase Reference)
EPA Substance Registry System1-Octanesulfonyl chloride (7795-95-1)
Safety Information
Hazard Codes C
Risk Statements 34-37
Safety Statements 26-36/37/39-45
RIDADR UN 3265 8/PG 2
WGK Germany 3
TSCA TSCA listed
HazardClass 8
PackingGroup II
HS Code 29049095
Storage Class8A - Combustible corrosive hazardous materials
Hazard ClassificationsSkin Corr. 1B
MSDS Information
ProviderLanguage
ACROS English
SigmaAldrich English
ALFA English
1-Octanesulfonyl Chloride Usage And Synthesis
Chemical Propertiesclear colorless to slightly yellow liquid
Uses1-Octanesulfonyl chloride is suitable for use in the preparation of 1-alkyl-3-methylimidazolium alkylsulfonates (ionic liquids).
SynthesisA mixture of 1-Mercaptooctane (1 mmol), 30 percent H2O2 (3 mmol, 0.3 mL), and TiCl4 (1 mmol, 0.11 mL) was stirred in CH3CN at 25 °C. A white solid (TiO2) immediately precipitated. After completion of the reaction as indicated by TLC, the mixture was quenched by adding H2O (10 mL), extracted with EtOAc (4 .x. 5 mL), and the extract was dried over anhydrous MgSO4. The filtrate was evaporated under a vacuum to afford the analytically pure product 1-Octanesulfonyl Chloride.
References[1] Journal of Organic Chemistry, 2009, vol. 74, # 24, p. 9287 - 9291
[2] Synlett, 2009, # 17, p. 2773 - 2776
[3] Synthesis, 2012, vol. 2012, # 2, p. 316 - 322
[4] Tetrahedron Letters, 2012, vol. 53, # 3, p. 354 - 358
[5] Green Chemistry, 2017, vol. 19, # 9, p. 2286 - 2295
Tag:1-Octanesulfonyl Chloride(7795-95-1) Related Product Information
Ethane Hexane 1-octanesulphonyl fluoride Sodium 1-octanesulfonate 1-Octane sulfonic acid 1-Octanesulfonamide 1-Dodecanesulfonyl chloride Perfluorooctanesulphonyl chloride 1-Octadecanesulfonyl chloride 1-Hexadecanesulfonyl chloride 1-Decanesulfonyl chloride 1-Octanesulfonyl Chloride adamantane-1-sulfonyl chloride 3,3,4,4,5,5,6,6,7,7,8,8,8-Tridecafluoro-1-octanesulfonyl chloride [S,(+)]-2-Octanesulfonyl chloride [R,(-)]-2-(2-2H)Octanesulfonyl chloride [S,(+)]-2-(2-2H)Octanesulfonyl chloride [R,(-)]-2-Octanesulfonyl chloride