2-(Methylthio)-3-phenylthiazolium iodide

Base Information

• Chemical Name: 2-(Methylthio)-3-phenylthiazolium iodide
• CAS No.: 33167-50-9
• Molecular Formula: C₁₀H₁₀NS₂*I
• Molecular Weight: 335.233
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID30594861
• Mol file: 33167-50-9.mol

Synonyms:33167-50-9;2-(Methylthio)-3-phenylthiazolium iodide;2-(Methylsulfanyl)-3-phenyl-1,3-thiazol-3-ium iodide;DTXSID30594861;AKOS024374891

Chemical Property of 2-(Methylthio)-3-phenylthiazolium iodide

Chemical Property:

• PSA: 57.42000
• LogP: -0.24930
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 334.92994
• Heavy Atom Count: 14
• Complexity: 157

Purity/Quality:

99% ^*data from raw suppliers

2-(METHYLTHIO)-3-PHENYLTHIAZOLIUMIODIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1=[N+](C=CS1)C2=CC=CC=C2.[I-]

Technology Process of 2-(Methylthio)-3-phenylthiazolium iodide

There total 4 articles about 2-(Methylthio)-3-phenylthiazolium iodide 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:

ammonium N-phenyldithiocarbamate (1074-52-8) → 2-methylsulfanyl-3-phenyl-thiazolium; iodide (33167-50-9)

Guidance literature:

Multi-step reaction with 2 steps

1: H₂O

2: 1 h / 95 °C

In water;

Reference yield:

N-phenyl-4-hydroxy-1,3-thiazolidin-2-thione (33174-72-0) → 2-methylsulfanyl-3-phenyl-thiazolium; iodide (33167-50-9)

Guidance literature:

Multi-step reaction with 2 steps

1: aq. HCl / 1 h / Heating

2: 0.25 h / Heating

With hydrogenchloride;

Reference yield:

methyl iodide (74-88-4) + N-phenyl-4-hydroxy-1,3-thiazolidin-2-thione (33174-72-0) → 2-methylsulfanyl-3-phenyl-thiazolium; iodide (33167-50-9)

Guidance literature:

at 95 ℃; for 1h;

upstream raw materials:

3-phenyl-1,3-thiazole-2(3H)-thione

methyl iodide

N-phenyl-4-hydroxy-1,3-thiazolidin-2-thione

ammonium N-phenyldithiocarbamate

Downstream raw materials:

bis-(3-phenyl-3H-thiazol-2-ylidene)-hydrazine

3-phenyl-3H-thiazol-2-one hydrazone

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