[(2-Formyl-6-methoxyphenyl)sulfanyl]acetic acid

Base Information

• Chemical Name: [(2-Formyl-6-methoxyphenyl)sulfanyl]acetic acid
• CAS No.: 88791-06-4
• Molecular Formula: C10H10O4S
• Molecular Weight: 226.253
• DSSTox Substance ID: DTXSID00519728
• Wikidata: Q82383122

Synonyms:88791-06-4;[(2-Formyl-6-methoxyphenyl)sulfanyl]acetic acid;SCHEMBL6329216;DTXSID00519728

Chemical Property of [(2-Formyl-6-methoxyphenyl)sulfanyl]acetic acid

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 226.02997997
• Heavy Atom Count: 15
• Complexity: 232

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC(=C1SCC(=O)O)C=O

Technology Process of [(2-Formyl-6-methoxyphenyl)sulfanyl]acetic acid

There total 5 articles about [(2-Formyl-6-methoxyphenyl)sulfanyl]acetic acid 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: 90.0%

sodium monochloroacetic acid (3926-62-3) + 2-mercapto-3-methoxybenzaldehyde (88791-05-3) → (2-formyl-6-methoxyphenylthio)acetic acid (88791-06-4)

Guidance literature:

In water; for 4h; Heating;

Reference yield:

3-methoxy-2-hydroxybenzaldehyde (148-53-8) → (2-formyl-6-methoxyphenylthio)acetic acid (88791-06-4)

Guidance literature:

Multi-step reaction with 4 steps

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

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

3: 90 percent / NaOH / methanol; H₂O / 1 h / Heating

4: 90 percent / H₂O / 4 h / Heating

With potassium hydroxide; sodium hydroxide; In tetrahydrofuran; methanol; diphenylether; water;

Reference yield:

O-(2-formyl-6-methoxyphenyl)-N,N-dimethylthiocarbamate (88791-03-1) → (2-formyl-6-methoxyphenylthio)acetic acid (88791-06-4)

Guidance literature:

Multi-step reaction with 3 steps

1: 90 percent / diphenyl ether / 0.25 h / 240 - 250 °C

2: 90 percent / NaOH / methanol; H₂O / 1 h / Heating

3: 90 percent / H₂O / 4 h / Heating

With sodium hydroxide; In methanol; diphenylether; water;

upstream raw materials:

sodium monochloroacetic acid

2-mercapto-3-methoxybenzaldehyde

3-methoxy-2-hydroxybenzaldehyde

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

Downstream raw materials:

7-methoxybenzothiophene-2-carboxylic acid

7-hydroxybenzo[b]thiophene

7-methoxybenzothiophene

4-bromo-7-methoxybenzothiophene

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