2-Benzamido-3-(4-methoxyphenyl)prop-2-enoic acid

Base Information

• Chemical Name: 2-Benzamido-3-(4-methoxyphenyl)prop-2-enoic acid
• CAS No.: 21542-84-7
• Molecular Formula: C17H15NO4
• Molecular Weight: 297.31
• DSSTox Substance ID: DTXSID20369666
• Mol file: 21542-84-7.mol

Synonyms:21542-84-7;2-Benzamido-3-(4-methoxyphenyl)acrylic acid;2-benzamido-3-(4-methoxyphenyl)prop-2-enoic acid;SBB015214;Maybridge3_005811;DTXSID20369666;AKOS025116709;(E)-2-benzamido-3-(4-methoxyphenyl)acrylic acid

Chemical Property of 2-Benzamido-3-(4-methoxyphenyl)prop-2-enoic acid

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 297.10010796
• Heavy Atom Count: 22
• Complexity: 418

Purity/Quality:

95+% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C=C(C(=O)O)NC(=O)C2=CC=CC=C2

Technology Process of 2-Benzamido-3-(4-methoxyphenyl)prop-2-enoic acid

There total 7 articles about 2-Benzamido-3-(4-methoxyphenyl)prop-2-enoic 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: 85.0%

4-(4-methoxybenzylidene)-2-phenyl-5(4H)-oxazolone (5429-22-1) → 2-benzoylamino-3-(4-methoxy-phenyl)-acrylic acid (21542-84-7)

Guidance literature:

With sodium hydroxide; In water; for 0.5h;

DOI:10.1080/00397911.2012.706350

Reference yield:

Hippuric Acid (495-69-2,140480-84-8,21251-67-2,91787-63-2,66407-11-2) → 2-benzoylamino-3-(4-methoxy-phenyl)-acrylic acid (21542-84-7)

Guidance literature:

Multi-step reaction with 2 steps

1: dicyclohexyl-carbodiimide

2: sodium hydroxide / water / 0.5 h

With dicyclohexyl-carbodiimide; sodium hydroxide; In water;

DOI:10.1080/00397911.2012.706350

Reference yield:

4-methoxy-benzaldehyde (123-11-5) → 2-benzoylamino-3-(4-methoxy-phenyl)-acrylic acid (21542-84-7)

Guidance literature:

Multi-step reaction with 2 steps

1: dicyclohexyl-carbodiimide

2: sodium hydroxide / water / 0.5 h

With dicyclohexyl-carbodiimide; sodium hydroxide; In water;

DOI:10.1080/00397911.2012.706350

upstream raw materials:

4-(4-methoxybenzylidene)-2-phenyl-5(4H)-oxazolone

Hippuric Acid

4-methoxy-benzaldehyde

Downstream raw materials:

2-benzoylamino-3-(4-methoxy-phenyl)-propionic acid

5-(4-methoxyphenyl)-2-phenyloxazole-4-carboxylic acid

4-Methoxyphenylacetic acid

benzoic acid