2-Propanol, 1-phenoxy-3-(phenylthio)-

Base Information

• Chemical Name: 2-Propanol, 1-phenoxy-3-(phenylthio)-
• CAS No.: 84137-77-9
• Molecular Formula: C15H16O2S
• Molecular Weight: 260.357
• DSSTox Substance ID: DTXSID90455146
• Nikkaji Number: J305.957J

Synonyms:2-Propanol, 1-phenoxy-3-(phenylthio)-;84137-77-9;1-phenoxy-3-phenylsulfanylpropan-2-ol;DTXSID90455146;1-(Phenylthio)-3-phenoxy-2-propanol;1-phenoxy-3-(phenylthio) propan-2-ol;1-phenoxy-3-(phenylsulfanyl)-2-propanol

Chemical Property of 2-Propanol, 1-phenoxy-3-(phenylthio)-

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 260.08710092
• Heavy Atom Count: 18
• Complexity: 211

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OCC(CSC2=CC=CC=C2)O

Technology Process of 2-Propanol, 1-phenoxy-3-(phenylthio)-

There total 10 articles about 2-Propanol, 1-phenoxy-3-(phenylthio)- 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: 100.0%

Phenyl glycidyl ether (122-60-1,71031-02-2) + thiophenol (108-98-5) → 1-phenoxy-3-(phenylthio)propan-2-ol (84137-77-9)

Guidance literature:

With 1-methyl-2,3,4,6,7,8-hexahydro-1H-pyrimido[1,2-a]pyrimidine; at 30 ℃; for 0.5h; regioselective reaction; Neat (no solvent);

DOI:10.1016/j.jcat.2011.09.032

Reference yield: 95.0%

2-(phenylsulfanylmethyl)oxirane (5296-21-9) + potassium phenolate (100-67-4) → 1-phenoxy-3-(phenylthio)propan-2-ol (84137-77-9)

Guidance literature:

In tetrahydrofuran; water; for 48h;

DOI:10.1055/s-1987-28113

Reference yield: 94.0%

Phenyl glycidyl ether (122-60-1,71031-02-2) + thiophenol (108-98-5) → 1-phenoxy-3-(phenylthio)propan-2-ol (84137-77-9) + 3-Phenoxy-2-phenylsulfanyl-propan-1-ol

Guidance literature:

With 1,3,5-trichloro-2,4,6-triazine; at 20 ℃; for 0.333333h;

DOI:10.1071/CH07079

upstream raw materials:

2-(phenylsulfanylmethyl)oxirane

potassium phenolate

S-phenyl thioacetate

Phenyl glycidyl ether

Downstream raw materials:

(Z)-4-Dimethylamino-1-phenoxy-3-phenylsulfanyl-but-3-en-2-one

2-acetoxy-3-(phenylthio)propyl phenyl ether

1-phenoxy-3-(phenylthio)propan-2-one

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