7,14,15-Trithiadispiro(5.1.5.2)pentadecane

Base Information

• Chemical Name: 7,14,15-Trithiadispiro(5.1.5.2)pentadecane
• CAS No.: 179-01-1
• Molecular Formula: C12H20S3
• Molecular Weight: 260.489
• NSC Number: 160440
• UNII: LN41MVB319
• DSSTox Substance ID: DTXSID30170760
• Nikkaji Number: J2.829.255D
• Wikidata: Q83040778
• Mol file: 179-01-1.mol

Synonyms:7,14,15-Trithiadispiro(5.1.5.2)pentadecane;179-01-1;LN41MVB319;NSC160440;NSC 160440;UNII-LN41MVB319;NSC-160440;7,14,15-Trithiadispiro[5.1.5.2]pentadecane;7,14,15-trithiadispiro[5.1.5^{8}.2^{6}]pentadecane;DTXSID30170760;1,2,4-TRITHIOLANE, 3,3:5,5-BIS(1,5-PENTANEDIYL)-

Chemical Property of 7,14,15-Trithiadispiro(5.1.5.2)pentadecane

Chemical Property:

• Vapor Pressure: 2.3E-06mmHg at 25°C
• Boiling Point: 403.9°Cat760mmHg
• Flash Point: 204.2°C
• Density: 1.22g/cm³
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 260.07271416
• Heavy Atom Count: 15
• Complexity: 203

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC2(CC1)SC3(CCCCC3)SS2

Technology Process of 7,14,15-Trithiadispiro(5.1.5.2)pentadecane

There total 6 articles about 7,14,15-Trithiadispiro(5.1.5.2)pentadecane 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: 35.5%

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → 3,3,5,5-bis(pentamethylene)-1,2,4-trithiolane (179-01-1)

Guidance literature:

With hydrogen sulfide; iodine; In chloroform; at -30 ℃; for 1h;

DOI:10.1134/S1070428008090303

Reference yield:

4-cyclohexen-1-ylmorpholine (670-80-4) → 3,3,5,5-bis(pentamethylene)-1,2,4-trithiolane (179-01-1)

Guidance literature:

With hydrogen sulfide; sulfur;

Reference yield:

cyclohexanone (108-94-1,11119-77-0,9003-41-2,9075-99-4) → 3,3,5,5-bis(pentamethylene)-1,2,4-trithiolane (179-01-1) + 5,6,7,7a-tetrahydro-4H-spiro[benzothiazole-2,1'-cyclohexane] (6675-28-1)

Guidance literature:

With hydrogen sulfide; ammonia; sulfur;

upstream raw materials:

4-cyclohexen-1-ylmorpholine

cyclohexanone

hydrogen sulfide

N-butylamine

Downstream raw materials:

(C₆H₁₀)S₂Pt(PPh₃)2

cyclohexanethione

cyclohexene

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