(3Z,7Z)-3,4,7,8-tetrakis(trifluoromethyl)-1,2,5,6-tetrathiocine

Base Information

• Chemical Name: (3Z,7Z)-3,4,7,8-tetrakis(trifluoromethyl)-1,2,5,6-tetrathiocine
• CAS No.: 651-38-7
• Molecular Formula: C8F12S4
• Molecular Weight: 452.3264
• NSC Number: 244325
• DSSTox Substance ID: DTXSID70418375
• Wikidata: Q82228885

Synonyms:NSC244325;651-38-7;DTXSID70418375;NSC-244325

Chemical Property of (3Z,7Z)-3,4,7,8-tetrakis(trifluoromethyl)-1,2,5,6-tetrathiocine

Chemical Property:

• Vapor Pressure: 2.15mmHg at 25°C
• Boiling Point: 168.3°Cat760mmHg
• Flash Point: 55.6°C
• Density: 1.804g/cm³
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 0
• Exact Mass: 451.8691226
• Heavy Atom Count: 24
• Complexity: 447

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1(=C(SSC(=C(SS1)C(F)(F)F)C(F)(F)F)C(F)(F)F)C(F)(F)F
• Isomeric SMILES: C\1(=C(\SS/C(=C(\SS1)/C(F)(F)F)/C(F)(F)F)/C(F)(F)F)/C(F)(F)F

Technology Process of (3Z,7Z)-3,4,7,8-tetrakis(trifluoromethyl)-1,2,5,6-tetrathiocine

There total 3 articles about (3Z,7Z)-3,4,7,8-tetrakis(trifluoromethyl)-1,2,5,6-tetrathiocine 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:

4,5-bis(trifluoromethyl)-1,2,3-trithiolylium hexafluoroarsenate → 3,4,7,8-Tetrakis(trifluormethyl)-1,2,5,6-tetrathiocin (651-38-7) + 3,4-bis-trifluoromethyl-[1,2]dithiete (360-91-8) + 2,3,5,6-tetrakis(trifluoromethyl)-p-dithiine (654-60-4) + 4,5-Bis-trifluoromethyl-[1,2,3]trithiole (142087-13-6)

Guidance literature:

With potassium iodide; In liquid sulphur dioxide; for 17h;

DOI:10.1039/DT9920001563

Reference yield:

3,4-bis-trifluoromethyl-[1,2]dithiete (360-91-8) → 3,4,7,8-Tetrakis(trifluormethyl)-1,2,5,6-tetrathiocin (651-38-7)

Guidance literature:

With triethylamine or acrylnitrile;

DOI:10.1021/ja01491a072 DOI:10.1021/ja01477a020

Reference yield:

→ 3,4,7,8-Tetrakis(trifluormethyl)-1,2,5,6-tetrathiocin (651-38-7)

Guidance literature:

3,4-Bis-(trifluormethyl)-1,2-dithieten (C4F6S2), 2 Monate 25grad;

DOI:10.1021/ja01477a020

upstream raw materials:

3,4-bis-trifluoromethyl-[1,2]dithiete

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