Benzene, [(2-phenylethenyl)thio]-

Base Information

• Chemical Name: Benzene, [(2-phenylethenyl)thio]-
• CAS No.: 16619-61-7
• Molecular Formula: C14H12S
• Molecular Weight: 212.315
• European Community (EC) Number: 667-687-2
• Nikkaji Number: J542.688J,J344.227F
• Mol file: 16619-61-7.mol

Synonyms:phenyl styryl sulfide;Phenyl .beta.-styryl sulfide;16619-61-7;phenyl trans-styryl sulphide;Phenyl((E)-styryl) sulfide;NCSYOCXYJXZCGQ-VAWYXSNFSA-N;{[(E)-2-phenylethenyl]thio}benzene;[(E)-2-phenylsulfanyl-vinyl]-benzene;AKOS024324578;[(E)-2-(Phenylsulfanyl)ethenyl]benzene;[(E)-2-(Phenylsulfanyl)ethenyl]benzene #

Chemical Property of Benzene, [(2-phenylethenyl)thio]-

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 212.06597156
• Heavy Atom Count: 15
• Complexity: 186

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C=CSC2=CC=CC=C2
• Isomeric SMILES: C1=CC=C(C=C1)/C=C/SC2=CC=CC=C2

Technology Process of Benzene, [(2-phenylethenyl)thio]-

There total 42 articles about Benzene, [(2-phenylethenyl)thio]- 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: 98.0%

bromostyrene (103-64-0,1340-14-3) + thiophenol (108-98-5) → 1-phenyl-2-phenylthioethene (16619-61-7)

Guidance literature:

With N,N-diethylaniline; tetrakis(triethylphosphite)nickel⁽⁰⁾; In N,N-dimethyl-formamide; at 70 ℃; for 23h;

DOI:10.1016/j.tet.2006.08.001

Reference yield: 97.0%

thiophenol (108-98-5) + phenylacetylene (536-74-3) → 1-phenyl-2-phenylthioethene (16619-61-7)

Guidance literature:

In ammonia; for 24h; Ambient temperature;

DOI:10.1246/cl.1983.1351

Reference yield: 97.0%

E-styryl iodide (42599-24-6) + mercury thiophenolate (21514-24-9,71914-41-5) → 1-phenyl-2-phenylthioethene (16619-61-7)

Guidance literature:

In dimethyl sulfoxide; at 35 - 40 ℃; for 24h; Irradiation;

DOI:10.1021/ja00328a057

upstream raw materials:

E-styryl iodide

mercury thiophenolate

bromostyrene

sodium thiophenolate

Downstream raw materials:

1,1-dimethoxy-2-(phenylthio)-2-phenylethane

benzoic acid

(+/-)_S-(Z)-2-phenyl-1-(phenylsulfinyl)ethene

(E)-2-phenyl-1-(phenylsulfinyl)ethene