2-(N,N-dimethylcarbamoylthio)-3-methoxybenzaldehyde

Base Information

• Chemical Name: 2-(N,N-dimethylcarbamoylthio)-3-methoxybenzaldehyde
• CAS No.: 88791-04-2
• Molecular Formula: C11H13NO3S
• Molecular Weight: 239.295
• DSSTox Substance ID: DTXSID80519726
• Nikkaji Number: J3.524.750E
• Wikidata: Q82383119

Synonyms:88791-04-2;2-(N,N-dimethylcarbamoylthio)-3-methoxybenzaldehyde;SCHEMBL6336678;DTXSID80519726;YPVRHIKRKOSZBR-UHFFFAOYSA-N;S-(2-Formyl-6-methoxyphenyl) dimethylcarbamothioate

Chemical Property of 2-(N,N-dimethylcarbamoylthio)-3-methoxybenzaldehyde

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 239.06161445
• Heavy Atom Count: 16
• Complexity: 258

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CN(C)C(=O)SC1=C(C=CC=C1OC)C=O

Technology Process of 2-(N,N-dimethylcarbamoylthio)-3-methoxybenzaldehyde

There total 2 articles about 2-(N,N-dimethylcarbamoylthio)-3-methoxybenzaldehyde 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: 98.0%

O-(2-formyl-6-methoxyphenyl)-N,N-dimethylthiocarbamate (88791-03-1) → S-(2-formyl-6-methoxyphenyl)-N,N-dimethylthiocarbamate (88791-04-2)

Guidance literature:

With 2,4,6-tris(4-methylphenyl)pyrylium tetrafluoroborate; In acetonitrile; for 24h; Inert atmosphere; Irradiation;

DOI:10.1021/jacs.5b11800

Reference yield:

3-methoxy-2-hydroxybenzaldehyde (148-53-8) → S-(2-formyl-6-methoxyphenyl)-N,N-dimethylthiocarbamate (88791-04-2)

Guidance literature:

Multi-step reaction with 2 steps

1: 85 percent / KOH / tetrahydrofuran; H₂O / 0.17 h / Ambient temperature

2: 90 percent / diphenyl ether / 0.25 h / 240 - 250 °C

With potassium hydroxide; In tetrahydrofuran; diphenylether; water;

Reference yield: 90.0%

S-(2-formyl-6-methoxyphenyl)-N,N-dimethylthiocarbamate (88791-04-2) → 2-mercapto-3-methoxybenzaldehyde (88791-05-3)

Guidance literature:

With sodium hydroxide; In methanol; water; for 1h; Heating;

upstream raw materials:

O-(2-formyl-6-methoxyphenyl)-N,N-dimethylthiocarbamate

3-methoxy-2-hydroxybenzaldehyde

Downstream raw materials:

7-methoxybenzothiophene-2-carboxylic acid

2-mercapto-3-methoxybenzaldehyde

2-allylsulfanyl-3-methoxybenzaldehyde

7-hydroxybenzo[b]thiophene

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 88791-04-2 Carbamothioic acid, dimethyl-, S-(2-formyl-6-methoxyphenyl) ester

Send

Send

Metric Ton KG G Pound L ML

Send

Send