Octahydrocycloocta(d)(1,3)dithiol-2-imine

Base Information

• Chemical Name: Octahydrocycloocta(d)(1,3)dithiol-2-imine
• CAS No.: 1128-99-0
• Molecular Formula: C₉H₁₅NS₂
• Molecular Weight: 201.357
• NSC Number: 122345
• DSSTox Substance ID: DTXSID90920900

Synonyms:Octahydrocycloocta(d)(1,3)dithiol-2-imine;1128-99-0;NSC122345;NSC 122345;Octahydrocycloocta[d][1,3]dithiol-2-imine;3a,4,5,6,7,8,9,9a-octahydrocycloocta[d][1,3]dithiol-2-imine;DTXSID90920900;NSC-122345;Octahydro-2H-cycloocta[d][1,3]dithiol-2-imine

Chemical Property of Octahydrocycloocta(d)(1,3)dithiol-2-imine

Chemical Property:

• Vapor Pressure: 0.00164mmHg at 25°C
• Boiling Point: 303.8°Cat760mmHg
• Flash Point: 137.5°C
• Density: 1.37g/cm³
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 201.06459183
• Heavy Atom Count: 12
• Complexity: 163

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCCC2C(CC1)SC(=N)S2

Technology Process of Octahydrocycloocta(d)(1,3)dithiol-2-imine

There total 1 articles about Octahydrocycloocta(d)(1,3)dithiol-2-imine 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:

→ trans-1,2-Carbimidoyldithio-cyclooctan (1128-99-0)

Guidance literature:

aus trans-1,2-Dithiocyanato-cyclooctan beim Erhitzen mit 47 percentig. HBr, anschl. Neutralisation mit Soda;

DOI:10.1021/ja01082a057

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