Diphenyl-bis(1,1,1,3,3,3-hexafluoro-2-phenyl-2-propoxy)sulfurane

Base Information

• Chemical Name: Diphenyl-bis(1,1,1,3,3,3-hexafluoro-2-phenyl-2-propoxy)sulfurane
• CAS No.: 32133-82-7
• Molecular Formula: C30H20 F12 O2 S
• Molecular Weight: 672.534
• Hs Code.: 29309090
• European Community (EC) Number: 628-306-5
• UNII: F9631K90E5
• DSSTox Substance ID: DTXSID90394127
• Nikkaji Number: J675.164D
• Wikipedia: Martin%27s_sulfurane,Martin's_sulfurane
• Wikidata: Q27277838
• Mol file: 32133-82-7.mol

Synonyms:32133-82-7;Martin Sulfurane;Bis[alpha,alpha-bis(trifluoromethyl)benzenemethanolato]diphenylsulfur;Martin's sulfurane;Diphenyl-bis(1,1,1,3,3,3-hexafluoro-2-phenyl-2-propoxy)sulfurane;Martin Sulfurane Dehydrating agent;Martin sulfurane [MI];bis[(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)oxy]-diphenyl-lambda4-sulfane;UNII-F9631K90E5;Bis(bis(trifluoromethyl)phenylmethoxy)diphenylsulfurane;F9631K90E5;Diphenylbis(1,1,1,3,3,3-hexafluoro-2-phenyl-2-propoxy)sulfurane;Sulfur, bis(alpha,alpha-bis(trifluoromethyl)benzenemethanolato-kappaO)diphenyl-, (T-4)-;Bis[bis(trifluoromethyl)phenylmethoxy]diphenylsulfurane;SCHEMBL1356076;DTXSID90394127;MFCD00010662;BS-44068;B2200;CS-0133095;D85638;Bis[a,a-bis(trifluoromethyl)benzyloxy]diphenylsulfur;J-018645;Martin Sulfurane Dehydrating agent, technical grade;Q27277838;Bis[alpha,alpha-bis(trifluoromethyl)benzyloxy]diphenylsulfur;bis [alpha,alpha-bis(trifluoromethyl)benzenemethanolato]-diphenyl-sulfur;Bis((1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)oxy)diphenyl-l4-sulfane;bis[alpha,alpha-bis(trifluoromethyl)benzene-methanolato]diphenylsulfur;Sulfur, bis[[.alpha.,.alpha.-bis(trifluoromethyl)benzyl]oxy]diphenyl-;Sulfur, diphenylbis[2,2,2-trifluoro-1-phenyl-1-(trifluoromethyl)ethoxy]-;(T-4)-Bis[-alpha,-alpha-bis-nu(trifluoromethyl)benzenemethanolato-?O]diphenylsulfur;(T-4)-Bis[alpha,-alpha-bisNu(trifluoromethyl)benzenemethanolato-Kappa-O]diphenylsulfur;Sulfur, bis[.alpha.,.alpha.-bis(trifluoromethyl)benzenemethanolato]diphenyl-, (T-4)-;SULFUR, BIS(.ALPHA.,.ALPHA.-BIS(TRIFLUOROMETHYL)BENZENEMETHANOLATO-.KAPPA.O)DIPHENYL-, (T-4)-

Chemical Property of Diphenyl-bis(1,1,1,3,3,3-hexafluoro-2-phenyl-2-propoxy)sulfurane

Chemical Property:

• Melting Point: 106-108 °C(lit.)
• Refractive Index: 1.477
• PSA: 43.76000
• Density: 1.32g/cm³
• LogP: 10.81260
• Storage Temp.: Freezer
• Solubility.: soluble in Methanol
• XLogP3: 11.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 8
• Exact Mass: 672.0992390
• Heavy Atom Count: 45
• Complexity: 833

Purity/Quality:

98%,99%, ^*data from raw suppliers

Bis[α,α-bis(trifluoromethyl)benzenemethanolato]diphenylsulfur ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(C(F)(F)F)(C(F)(F)F)OS(C2=CC=CC=C2)(C3=CC=CC=C3)OC(C4=CC=CC=C4)(C(F)(F)F)C(F)(F)F
• Uses: Versatile dehydrating and oxidizing agent. For chemistry and references, see Aldrichimica Acta .

Technology Process of Diphenyl-bis(1,1,1,3,3,3-hexafluoro-2-phenyl-2-propoxy)sulfurane

There total 3 articles about Diphenyl-bis(1,1,1,3,3,3-hexafluoro-2-phenyl-2-propoxy)sulfurane 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:

diphenyl sulfide (139-66-2) + potassium 1,1,1,3,3,3-hexafluoro-2-phenyl-2-propoxide (37818-31-8) → Martins sulfurane (32133-82-7)

Guidance literature:

With chlorine; In tetrachloromethane;

DOI:10.1021/ja00530a035

Reference yield:

diphenyl sulfide (139-66-2) + 1,1,1,3,3,3-hexafluoro-2-phenylisopropyl alcohol (718-64-9) → Martins sulfurane (32133-82-7)

Guidance literature:

1,1,1,3,3,3-hexafluoro-2-phenylisopropyl alcohol; With sodium hydride; In tetrachloromethane; at 20 ℃; for 0.5h; Inert atmosphere;

diphenyl sulfide; With bromine; In tetrachloromethane; at 20 ℃; for 1h; Inert atmosphere;

DOI:10.1002/anie.201803018

Reference yield:

→ Martins sulfurane (32133-82-7)

Guidance literature:

K-1,1,1,3,3,3-Hexafluoro-2-phenyl-2-propanolat + /BRN= 907932/ + Brom.;

upstream raw materials:

diphenyl sulfide

potassium 1,1,1,3,3,3-hexafluoro-2-phenyl-2-propoxide

1,1,1,3,3,3-hexafluoro-2-phenylisopropyl alcohol

Downstream raw materials:

2-(2-(phenylthio)phenyl)cyclohexanone

C₂₃H₂₀F₁₂O₂

C₂₂H₁₈F₁₂O₂

C₂₄H₂₂F₁₂O₂

Refernces

• 1、 Bartlett, Paul D.,Aida, Tetsuo,Chu, Hsien-Kun,Fang, Tai-Shan. "Chemiluminescence in the Reaction of a Sulfurane with Alkyl Hydroperoxides". . p. 3515 - 3524. Retrieved 2007/10/02.