1,1',1''-(Ethane-1,1,1-triyltrisulfanediyl)tribenzene

Base Information

• Chemical Name: 1,1',1''-(Ethane-1,1,1-triyltrisulfanediyl)tribenzene
• CAS No.: 14859-20-2
• Molecular Formula: C20H18 S3
• Molecular Weight: 354.561
• NSC Number: 101048
• DSSTox Substance ID: DTXSID10933436
• Nikkaji Number: J427.309E
• Wikidata: Q82909252
• Mol file: 14859-20-2.mol

Synonyms:14859-20-2;1,1',1''-(ethane-1,1,1-triyltrisulfanediyl)tribenzene;NSC101048;DTXSID10933436;AKOS003384446;NSC-101048

Chemical Property of 1,1',1''-(Ethane-1,1,1-triyltrisulfanediyl)tribenzene

Chemical Property:

• Boiling Point: 493.5°Cat760mmHg
• Flash Point: 255°C
• Density: 1.24g/cm³
• XLogP3: 7.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 354.05706409
• Heavy Atom Count: 23
• Complexity: 276

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(SC1=CC=CC=C1)(SC2=CC=CC=C2)SC3=CC=CC=C3

Technology Process of 1,1',1''-(Ethane-1,1,1-triyltrisulfanediyl)tribenzene

There total 25 articles about 1,1',1''-(Ethane-1,1,1-triyltrisulfanediyl)tribenzene 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: 60.0%

(4-methylphenyl)acetonitrile (2947-61-7) + S-phenylthiopropionate (18245-72-2) → {[1,1-bis(phenylthio)ethyl]thio}benzene (14859-20-2) + diphenyldisulfane (882-33-7) + (4Z)-2-ethyl-4-(4-methylbenzylidene)-4H-1,3-benzothiazine

Guidance literature:

With trifluoromethylsulfonic anhydride; In dichloromethane; at 0 ℃; for 72h;

DOI:10.1021/jo049777r

Reference yield: 59.0%

S-phenyl thioacetate (934-87-2) + p-chlorobenzyl cyanide (140-53-4) → {[1,1-bis(phenylthio)ethyl]thio}benzene (14859-20-2) + diphenyldisulfane (882-33-7) + (4Z)-4-(4-chlorobenzylidene)-2-methyl-4H-1,3-benzothiazine

Guidance literature:

With trifluoromethylsulfonic anhydride; In dichloromethane; at 0 ℃; for 72h;

DOI:10.1021/jo049777r

Reference yield: 56.0%

veratronitrile (2024-83-1) + S-phenyl thioacetate (934-87-2) → {[1,1-bis(phenylthio)ethyl]thio}benzene (14859-20-2) + 2,4-bis(3,4-dimethoxyphenyl)-6-(phenylthio)pyrimidine

Guidance literature:

With trifluoromethylsulfonic anhydride; In dichloromethane; at -78 - 0 ℃;

DOI:10.1016/S0040-4020(03)01133-5

upstream raw materials:

S-phenyl thioacetate

thiophenol

tris(phenylthio)methane

methyl iodide

Downstream raw materials:

1,1-Bis-phenylmercapto-aethylen

β-trifluoroacetylketene S,S-acetal

C₂₇H₂₆S₃

1,1,5-Tris-phenylsulfanyl-spiro[2.5]oct-4-ene

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