2-((2,4-DiMethylphenyl)thio)phenylaMine

Base Information

• Chemical Name: 2-((2,4-DiMethylphenyl)thio)phenylaMine
• CAS No.: 1019453-85-0
• Molecular Formula: C14H15NS
• Molecular Weight: 229.346
• Mol file: 1019453-85-0.mol

Synonyms:2-((2,4-DiMethylphenyl)thio)phenylaMine;2-[(2,4-diMethylphenyl)thio]-BenzenaMine;2-((2,4-dimethylphenyl)thio)aniline

Chemical Property of 2-((2,4-DiMethylphenyl)thio)phenylaMine

Chemical Property:

• Boiling Point: 341.3±30.0 °C(Predicted)
• PKA: 3.12±0.10(Predicted)
• PSA: 51.32000
• Density: 1.14±0.1 g/cm3(Predicted)
• LogP: 4.61800
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C

Purity/Quality:

HPLC>99% ^*data from raw suppliers

2-[(2,4-Dimethylphenyl)sulfanyl]aniline ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Uses: 2-[(2,4-Dimethylphenyl)sulfanyl]aniline is used in the study of N-O-glucuronide metabolites of Lu AA21004 (Vortioxetine [V766000]), an antidepressant.

Technology Process of 2-((2,4-DiMethylphenyl)thio)phenylaMine

There total 36 articles about 2-((2,4-DiMethylphenyl)thio)phenylaMine 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%

2,4-dimethyl-1-[(2-nitro-phenyl)-sulfanyl]-benzene (1610527-49-5) → 2-(2,4-dimethylphenylsulphanyl)benzeneamine (1019453-85-0)

Guidance literature:

With hydrogen; In methanol; at 45 ℃;

Reference yield: 99.0%

bis(2,4-dimethylphenyl)iodonium bromide (54958-15-5) + 2-Aminophenyl disulfide (1141-88-4) → 2-(2,4-dimethylphenylsulphanyl)benzeneamine (1019453-85-0)

Guidance literature:

With potassium tert-butylate; In dimethyl sulfoxide; at 40 - 80 ℃; for 3.25h; Solvent; Sealed tube;

Reference yield: 95.5%

2-(2,4-dimethylphenylsulfanyl)phenyl carbamic acid tert-butyl ester (1425794-19-9) → 2-(2,4-dimethylphenylsulphanyl)benzeneamine (1019453-85-0)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 20 - 25 ℃; for 2.5h; Temperature;

upstream raw materials:

2,4-dimethyl-1-[(2-nitro-phenyl)-sulfanyl]-benzene

2,4-dimethyl-thiophenol

2-Chloronitrobenzene

2-bromoaniline

Downstream raw materials:

2,4-dimethylphenyl phenyl sulfone

2,4-dimethylbenzothiophene 5,5-dioxide

(2S,3S,4S,5R,6S)-6-{4-[2-(2,4-dimethyl-phenylsulfanyl)-phenyl]-piperazin-1-yloxy}-3,4,5-trihydroxy-tetrahydro-pyran-2-carboxylic acid

Vortioxetine hydrobromide

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