Octakis(phenylsulfanyl)naphthalene

Base Information

• Chemical Name: Octakis(phenylsulfanyl)naphthalene
• CAS No.: 86831-17-6
• Molecular Formula: C58H40S8
• Molecular Weight: 993.484
• DSSTox Substance ID: DTXSID80583200
• Nikkaji Number: J726.486K
• Wikidata: Q82474732
• Mol file: 86831-17-6.mol

Synonyms:Octakis(phenylsulfanyl)naphthalene;86831-17-6;octakis-(phenylthio)naphthalene;SCHEMBL10348599;DTXSID80583200

Chemical Property of Octakis(phenylsulfanyl)naphthalene

Chemical Property:

• XLogP3: 19.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 16
• Exact Mass: 992.0895707
• Heavy Atom Count: 66
• Complexity: 1150

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)SC2=C(C(=C(C3=C2C(=C(C(=C3SC4=CC=CC=C4)SC5=CC=CC=C5)SC6=CC=CC=C6)SC7=CC=CC=C7)SC8=CC=CC=C8)SC9=CC=CC=C9)SC1=CC=CC=C1

Technology Process of Octakis(phenylsulfanyl)naphthalene

There total 3 articles about Octakis(phenylsulfanyl)naphthalene 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: 66.0%

octachloronaphthalene (2234-13-1) + sodium thiophenolate (930-69-8) → octakis(phenylthio)naphthalene (86831-17-6)

Guidance literature:

In N,N-dimethyl-formamide; for 5h; Ambient temperature;

Reference yield: 65.0%

octadecafluorodecahydronaphthalene (cis+trans) (306-94-5) + sodium thiophenolate (930-69-8) → octakis(phenylthio)naphthalene (86831-17-6)

Guidance literature:

With 1,3-dimethyl-2-imidazolidinone; at 50 - 60 ℃; for 240h;

DOI:10.1016/0040-4039(96)00294-8

Reference yield:

octafluoronaphthalene (313-72-4) + sodium thiophenolate (930-69-8) → octakis(phenylthio)naphthalene (86831-17-6)

Guidance literature:

With 1,3-dimethyl-2-imidazolidinone; for 48h; Yield given; Ambient temperature;

DOI:10.1039/c39830000362

upstream raw materials:

octachloronaphthalene

sodium thiophenolate

octafluoronaphthalene

octadecafluorodecahydronaphthalene (cis+trans)