2-(4-formyl-2-methoxyphenoxy)-N-(4-methylphenyl)acetamide

Base Information

• Chemical Name: 2-(4-formyl-2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
• CAS No.: 31438-74-1
• Molecular Formula: C₁₇H₁₇NO₄
• Molecular Weight: 299.326
• DSSTox Substance ID: DTXSID401186297
• Mol file: 31438-74-1.mol

Synonyms:31438-74-1;2-(4-formyl-2-methoxyphenoxy)-N-(4-methylphenyl)acetamide;2-(4-Formyl-2-methoxyphenoxy)-N-(p-tolyl)acetamide;MFCD01326078;Oprea1_060182;Oprea1_216550;SCHEMBL2558559;2-(4-Formyl-2-methoxy-phenoxy)- N - p -tolyl-acetamide;DTXSID401186297;BBL023930;STK353579;AKOS000115361;VS-07566;BB 0243299;CS-0281373;EN300-01110;2-(4-Formyl-2-methoxy-phenoxy)-N-p-tolyl-ac etamide;Z19660674;Acetamide, 2-(4-formyl-2-methoxyphenoxy)-N-(4-methylphenyl)-

Chemical Property of 2-(4-formyl-2-methoxyphenoxy)-N-(4-methylphenyl)acetamide

Chemical Property:

• Boiling Point: 538.7±45.0 °C(Predicted)
• PKA: 13.25±0.70(Predicted)
• Density: 1.232±0.06 g/cm3(Predicted)
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 299.11575802
• Heavy Atom Count: 22
• Complexity: 366

Purity/Quality:

98%min ^*data from raw suppliers

2-(4-Formyl-2-methoxy-phenoxy)-N-p-tolyl-acetamide ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C=C2)C=O)OC

Technology Process of 2-(4-formyl-2-methoxyphenoxy)-N-(4-methylphenyl)acetamide

There total 5 articles about 2-(4-formyl-2-methoxyphenoxy)-N-(4-methylphenyl)acetamide 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:

C10H9ClO4 + p-toluidine (106-49-0,12221-03-3) → 2-(4-formyl-2-methoxyphenoxy)-N-(p-tolyl)acetamide (31438-74-1)

Guidance literature:

With sodium hydrogencarbonate; In dichloromethane; at 20 ℃; for 4.5h;

DOI:10.1016/j.bmcl.2021.128194

Reference yield:

p-toluidine (106-49-0,12221-03-3) → 2-(4-formyl-2-methoxyphenoxy)-N-(p-tolyl)acetamide (31438-74-1)

Guidance literature:

Multi-step reaction with 2 steps

1.1: triethylamine / dichloromethane / 20 °C

2.1: potassium carbonate / 0.5 h / 20 °C

2.2: Reflux

With potassium carbonate; triethylamine; In dichloromethane;

DOI:10.1016/j.bmcl.2020.127113

Reference yield:

vanillin (121-33-5,8014-42-4) → 2-(4-formyl-2-methoxyphenoxy)-N-(p-tolyl)acetamide (31438-74-1)

Guidance literature:

Multi-step reaction with 3 steps

1: sodium hydroxide / water / 1.67 h / Reflux

2: thionyl chloride; N,N-dimethyl-formamide / dichloromethane / 12 h / 20 °C

3: sodium hydrogencarbonate / dichloromethane / 4.5 h / 20 °C

With thionyl chloride; sodium hydrogencarbonate; N,N-dimethyl-formamide; sodium hydroxide; In dichloromethane; water;

DOI:10.1016/j.bmcl.2021.128194

upstream raw materials:

vanillin

N-(p-tolyl)-2-chloroacetamide

p-toluidine

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