Sodium (oxolan-2-yl)methanide--sulfurothioic O,O-acid (1/1/1)

Base Information

• Chemical Name: Sodium (oxolan-2-yl)methanide--sulfurothioic O,O-acid (1/1/1)
• CAS No.: 77339-73-2
• Molecular Formula: C5H10 O4 S2 . Na
• Molecular Weight: 220.246
• Hs Code.: 2932190090
• DSSTox Substance ID: DTXSID60703762
• Mol file: 77339-73-2.mol

Synonyms:DTXSID60703762;Sodium (oxolan-2-yl)methanide--sulfurothioic O,O-acid (1/1/1)

Chemical Property of Sodium (oxolan-2-yl)methanide--sulfurothioic O,O-acid (1/1/1)

Chemical Property:

• PSA: 107.23000
• LogP: 2.19450
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 221.99964546
• Heavy Atom Count: 12
• Complexity: 145

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [CH2-]C1CCCO1.OS(=O)(=S)O.[Na+]

Technology Process of Sodium (oxolan-2-yl)methanide--sulfurothioic O,O-acid (1/1/1)

There total 2 articles about Sodium (oxolan-2-yl)methanide--sulfurothioic O,O-acid (1/1/1) 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:

tetrahydrofurfuryl bromide (1192-30-9) → sodium S-(1,2,3,4-tetrahydrofurfuryl) thiosulfate (77339-73-2)

Guidance literature:

With Sodium thiosulfate pentahydrate; In methanol; water; at 65 ℃; Inert atmosphere;

DOI:10.1021/acs.orglett.9b02784

Reference yield:

→ sodium S-(1,2,3,4-tetrahydrofurfuryl) thiosulfate (77339-73-2)

Guidance literature:

Reference yield: 60.0%

diphenyliodonium tetrafluoroborate + sodium S-(1,2,3,4-tetrahydrofurfuryl) thiosulfate (77339-73-2) → phenyl(tetrahydrofuran-2-methyl)sulfoxide

Guidance literature:

With zinc diacetate; N-ethyl-N,N-diisopropylamine; eosin y; In methanol; acetonitrile; for 24h; Irradiation;

DOI:10.1021/acscatal.7b02735

upstream raw materials:

tetrahydrofurfuryl bromide

Downstream raw materials:

(2R,4R)-2-(2-Hydroxy-phenyl)-3-[3-(tetrahydro-furan-2-ylmethyldisulfanyl)-propionyl]-thiazolidine-4-carboxylic acid