1-Methyl-3-(2,4,6-trimethylphenyl)thiourea

Base Information

• Chemical Name: 1-Methyl-3-(2,4,6-trimethylphenyl)thiourea
• CAS No.: 85451-84-9
• Molecular Formula: C₁₁H₁₆N₂S
• Molecular Weight: 208.327
• NSC Number: 203859
• DSSTox Substance ID: DTXSID50392523

Synonyms:85451-84-9;1-methyl-3-(2,4,6-trimethylphenyl)thiourea;NSC203859;SCHEMBL11511410;DTXSID50392523;AKOS003709171;NSC-203859

Chemical Property of 1-Methyl-3-(2,4,6-trimethylphenyl)thiourea

Chemical Property:

• Vapor Pressure: 0.00237mmHg at 25°C
• Boiling Point: 288.2°C at 760 mmHg
• Flash Point: 128.1°C
• Density: 1.107g/cm³
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 208.10341969
• Heavy Atom Count: 14
• Complexity: 194

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C(=C1)C)NC(=S)NC)C

Technology Process of 1-Methyl-3-(2,4,6-trimethylphenyl)thiourea

There total 1 articles about 1-Methyl-3-(2,4,6-trimethylphenyl)thiourea 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:

→ N-(2,4,6-Trimethylphenyl)-N'-methyl-thioharnstoff (85451-84-9)

Guidance literature:

2,4,6-Trimethylanilin, CH3-NCS, N(C2H5)3;

Reference yield: 45.0%

N-(2,4,6-Trimethylphenyl)-N'-methyl-thioharnstoff (85451-84-9) + bis(diethylamino)dimethylsilane (4669-59-4) → 2,4,6-trimethylphenyl isothiocyanate (6095-82-5) + 2,4,6-Trimethylphenylamino-diethylamino-dimethylsilan + 1,2,2,3,4,4-Hexamethyl-5-(2,4,6-trimethylphenyl)-1,3,5-triaza-2,4-disilacyclohexan-6-thion

Guidance literature:

In xylene; for 12h; Title compound not separated from byproducts; Heating;

Downstream raw materials:

2,4,6-trimethylphenyl isothiocyanate

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