3-(Dimethylamino)thiophenol

Base Information

• Chemical Name: 3-(Dimethylamino)thiophenol
• CAS No.: 33284-28-5
• Molecular Formula: C8H11NS
• Molecular Weight: 153.248
• Hs Code.: 2930909090
• European Community (EC) Number: 675-539-3
• DSSTox Substance ID: DTXSID60374370
• Nikkaji Number: J88.855I
• Wikidata: Q82162930
• Mol file: 33284-28-5.mol

Synonyms:3-(Dimethylamino)thiophenol;33284-28-5;3-(dimethylamino)benzenethiol;3-(dimethylamino)benzene-1-thiol;SCHEMBL487064;DTXSID60374370;AKOS006343078;FS-5841;FT-0694681;EN300-673758

Chemical Property of 3-(Dimethylamino)thiophenol

Chemical Property:

• PSA: 42.04000
• LogP: 2.04130
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 153.06122053
• Heavy Atom Count: 10
• Complexity: 103

Purity/Quality:

98%min ^*data from raw suppliers

3-(DIMETHYLAMINO)THIOPHENOL ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC(=CC=C1)S

Technology Process of 3-(Dimethylamino)thiophenol

There total 3 articles about 3-(Dimethylamino)thiophenol 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: 45.0%

3-bromo-N,N-dimethylaniline (16518-62-0) → 3-dimethylaminobenzenethio (33284-28-5)

Guidance literature:

3-bromo-N,N-dimethylaniline; With magnesium; In diethyl ether; for 5h; Reflux;

With sulfur; In diethyl ether; at 20 ℃; for 14h;

Reference yield:

Prop-1-en-1-thiol (925-89-3) + 3-bromo-N,N-dimethylaniline (16518-62-0) → 3-dimethylaminobenzenethio (33284-28-5)

Guidance literature:

With lithium;

DOI:10.1021/ja01582a027

Reference yield:

→ 3-dimethylaminobenzenethio (33284-28-5)

Guidance literature:

S-3-Dimethylaminophenyldimethylthiocarbamat, NaOH;

upstream raw materials:

Prop-1-en-1-thiol

3-bromo-N,N-dimethylaniline

Downstream raw materials:

N,N-dimethyl-3-(3-(1-methyl-1H-pyrazol-4-yl)-1-(2-(trimethylsilyl)ethoxymethyl)-1H-pyrrolo[2,3-b]pyridin-5-ylthio)aniline

N,N-Diethyl 4-N,N-Dimethylamino-2-[3-(N,N-dimethylamino)-phenylthio]benzamide

bis-3-(N,N-dimethylamino)phenyldisulfide