3-Phenylthio-1,2-epoxypropane

Base Information

• Chemical Name: 3-Phenylthio-1,2-epoxypropane
• CAS No.: 5296-21-9
• Molecular Formula: C9H10OS
• Molecular Weight: 166.244
• Hs Code.: 2930909090
• Nikkaji Number: J1.061.548H
• Mol file: 5296-21-9.mol

Synonyms:5296-21-9;2-[(phenylsulfanyl)methyl]oxirane;3-PHENYLTHIO-1,2-EPOXYPROPANE;2-(phenylsulfanylmethyl)oxirane;Glycidylphenyl sulfide;Phenylthiomethyloxirane;phenyl glycidyl thioether;2,3-epoxypropyl phenyl sulfide;SCHEMBL5513100;2-(phenylsulfanyl-methyl)-oxirane;MYBWNWNBXBBZKW-UHFFFAOYSA-N;AKOS000216768;EN300-814120;Z330820010

Chemical Property of 3-Phenylthio-1,2-epoxypropane

Chemical Property:

• PSA: 37.83000
• LogP: 2.17750
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 166.04523611
• Heavy Atom Count: 11
• Complexity: 121

Purity/Quality:

98% ^*data from raw suppliers

2-[(PHENYLSULFANYL)METHYL]OXIRANE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(O1)CSC2=CC=CC=C2

Technology Process of 3-Phenylthio-1,2-epoxypropane

There total 8 articles about 3-Phenylthio-1,2-epoxypropane 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%

thiophenol (108-98-5) + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) → 2-(phenylsulfanylmethyl)oxirane (5296-21-9)

Guidance literature:

With sodium hydroxide; In 1,4-dioxane; for 4h; Ambient temperature;

DOI:10.1246/bcsj.60.667

Reference yield: 82.0%

thiophenol (108-98-5) + 1,2-Epoxy-3-bromopropane (3132-64-7,82584-73-4) → 2-(phenylsulfanylmethyl)oxirane (5296-21-9)

Guidance literature:

In acetonitrile; 1.) room temperature, 2 h, 2.) reflux, 30 min;

Reference yield: 78.0%

potassium thiophenolate (3111-52-2) + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) → 2-(phenylsulfanylmethyl)oxirane (5296-21-9)

Guidance literature:

In ethanol; for 0.5h;

DOI:10.1055/s-1987-28113

upstream raw materials:

1-chloro-3-(phenylthio)propan-2-ol

potassium thiophenolate

epichlorohydrin

thiophenol

Downstream raw materials:

1-(4-phenyl-piperazin-1-yl)-3-phenylsulfanyl-propan-2-ol

1-phenylsulfanyl-3-(4-p-tolyl-piperazino)-propan-2-ol

1-phenylsulfanyl-3-(4-m-tolyl-piperazino)-propan-2-ol

1-[4-(4-chloro-phenyl)-piperazino]-3-phenylsulfanyl-propan-2-ol