Sodium 1-butanesulfonate

Base Information

• Chemical Name: Sodium 1-butanesulfonate
• CAS No.: 2386-54-1
• Molecular Formula: C4H9NaO3S
• Molecular Weight: 160.169
• Hs Code.: 29041000
• European Community (EC) Number: 219-201-1
• UNII: 8SX3XD39H3
• DSSTox Substance ID: DTXSID20883837
• Nikkaji Number: J208.044C
• Mol file: 2386-54-1.mol

Synonyms:1-Butanesulfonicacid, sodium salt (7CI,8CI,9CI);Butylsulfonic acid sodium salt;Sodium butanesulfonate;Sodium butylsulfonate;Sodiumn-butylsulfonate;

Chemical Property of Sodium 1-butanesulfonate

Chemical Property:

• Appearance/Colour: white to off-white crystalline powder
• Melting Point: >300 °C(lit.)
• PSA: 65.58000
• Density: 1.221g/cm3
• LogP: 1.41250
• Storage Temp.: Store below +30°C.
• Solubility.: H2O: 0.1 g/mL, clear to slightly hazy
• Water Solubility.: soluble
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 160.01700960
• Heavy Atom Count: 9
• Complexity: 134

Purity/Quality:

99% ^*data from raw suppliers

1-Butanesulfonicacidsodiumsalt ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn, Xi
• Hazard Codes: Xi,Xn
• Statements: 36/37/38-20/21/22
• Safety Statements: 37/39-26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCCCS(=O)(=O)[O-].[Na+]
• Uses: suzuki reaction Sodium 1-butanesulfonate was used in the synthesis of high silicon content SAPO4-5. It was also used as a mobile phase to separate eight selenium compounds (selenite, selenate, selenocystine, selenourea, selenomethionine, selenoethionine, selenocystamine and trimethylselenonium ion). Ion-associating reagent for HPLC1 and reversed-phase chromatography.

Technology Process of Sodium 1-butanesulfonate

There total 6 articles about Sodium 1-butanesulfonate 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: 65.2%

n-Butyl chloride (109-69-3) → 1-butanesulfonic acid sodium salt (2386-54-1)

Guidance literature:

With copper; sodium sulfite; In ethanol; water; for 40h; Reflux;

DOI:10.14233/ajchem.2014.16579

Reference yield:

butyl <2>betylate fluorosulfate → 1-butanesulfonic acid sodium salt (2386-54-1)

Guidance literature:

With sodium sulfite; In water; at 25 ℃; for 1h; pH 6.0;

DOI:10.1021/ja00389a038

Reference yield:

1-bromo-butane (109-65-9) → 1-butanesulfonic acid sodium salt (2386-54-1)

Guidance literature:

With sodium sulfite; In water; for 24h; Heating;

DOI:10.1016/j.bmcl.2004.07.088

upstream raw materials:

1-iodo-butane

perfluoro-1-butanesulfonyl fluoride

Trimethylsilyl-1-butansulfonat

1-bromo-butane

Downstream raw materials:

perfluoro-1-butanesulfonyl fluoride

2-phenyl-9-tetradecyl-benzo[8,9]quinolizino[4,5,6,7-fed]phenanthridinylium butanesulfonate

N-benzyl-2-(butane-1-sulfonyl)-acetamide

Refernces

• 1、 Castang, Sandra,Chantegrel, Bernard,Deshayes, Christian,Dolmazon, René,Gouet, Patrice,Haser, Richard,Reverchon, Sylvie,Nasser, William,Hugouvieux-Cotte-Pattat, Nicole,Doutheau, Alain. "N-Sulfonyl homoserine lactones as antagonists of bacterial quorum sensing". . p. 5145 - 5149. Retrieved 2007/10/03.
• 2、 Nakayama, Haruo,Yamanobe, Masashi,Baba, Kei. "Hydrates of Organic Compounds. XVI. Determination of the Melting Points and Hydration Numbers of the Hydrates of Tetrabutyl(or Tetraisopentyl)ammonium Alkanesulfonates". . p. 3023 - 3028. Retrieved 2007/10/02.