[Methyl(phenyl)amino]{[methyl(phenyl)amino]sulfanyl}methanone

Base Information

• Chemical Name: [Methyl(phenyl)amino]{[methyl(phenyl)amino]sulfanyl}methanone
• CAS No.: 87463-10-3
• Molecular Formula: C15H16N2OS
• Molecular Weight: 272.371
• DSSTox Substance ID: DTXSID90528405
• Wikidata: Q82398022
• Mol file: 87463-10-3.mol

Synonyms:87463-10-3;DTXSID90528405;[Methyl(phenyl)amino]{[methyl(phenyl)amino]sulfanyl}methanone;(N-Methyl-N-phenylamino)(N-methyl-N-phenylcarbamoyl)sulfide

Chemical Property of [Methyl(phenyl)amino]{[methyl(phenyl)amino]sulfanyl}methanone

Chemical Property:

• PSA: 48.85000
• LogP: 4.02740
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 272.09833431
• Heavy Atom Count: 19
• Complexity: 286

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C1=CC=CC=C1)C(=O)SN(C)C2=CC=CC=C2

Technology Process of [Methyl(phenyl)amino]{[methyl(phenyl)amino]sulfanyl}methanone

There total 15 articles about [Methyl(phenyl)amino]{[methyl(phenyl)amino]sulfanyl}methanone 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: 94.0%

N-(trimethylsilyl)phenyl(methyl)amine (17890-34-5) + chloro(chlorosulfanyl)methanone (2757-23-5) → (N,N'-dimethyl-N,N'-diphenylcarbamoyl)sulfenamide (87463-10-3)

Guidance literature:

In chloroform-d1; at 4 ℃; for 0.05h;

DOI:10.1021/jo201329n

Reference yield: 90.0%

O-methyl N-methyl-N-phenylcarbamothioate (87463-11-4) + N-methylaniline (100-61-8) → (N,N'-dimethyl-N,N'-diphenylcarbamoyl)sulfenamide (87463-10-3)

Guidance literature:

O-methyl N-methyl-N-phenylcarbamothioate; With sulfuryl dichloride; In chloroform-d1; at 25 ℃;

N-methylaniline; In chloroform-d1; for 0.0833333h;

DOI:10.1021/jo201329n

Reference yield: 85.0%

O-ethyl N-methyl-N-phenylthiocarbamate (87463-00-1) + N-methylaniline (100-61-8) → (N,N'-dimethyl-N,N'-diphenylcarbamoyl)sulfenamide (87463-10-3)

Guidance literature:

O-ethyl N-methyl-N-phenylthiocarbamate; With sulfuryl dichloride; In chloroform-d1; at 25 ℃;

N-methylaniline; In chloroform-d1; for 0.05h;

DOI:10.1021/jo201329n

upstream raw materials:

chloro(chlorosulfanyl)methanone

N-methylaniline

(methoxydichloromethyl)sulfenyl chloride

O-isopropyl S-methyl xanthate

Downstream raw materials:

3-methyl-(3H)benzothiazolone

N-methylaniline hydrochloride

(N-methyl-N-phenylcarbamoyl)sulfenyl chloride