2-benzamido-3-(2-methylphenyl)prop-2-enoic Acid

Base Information

• Chemical Name: 2-benzamido-3-(2-methylphenyl)prop-2-enoic Acid
• CAS No.: 72615-62-4
• Molecular Formula: C₁₇H₁₅NO₃
• Molecular Weight: 281.311
• DSSTox Substance ID: DTXSID00405753
• Mol file: 72615-62-4.mol

Synonyms:2-benzamido-3-(2-methylphenyl)prop-2-enoic Acid;DTXSID00405753

Chemical Property of 2-benzamido-3-(2-methylphenyl)prop-2-enoic Acid

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 281.10519334
• Heavy Atom Count: 21
• Complexity: 410

Purity/Quality:

99% ^*data from raw suppliers

(Z)-2-Benzamido-3-(o-tolyl)acrylicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC=CC=C1C=C(C(=O)O)NC(=O)C2=CC=CC=C2

Technology Process of 2-benzamido-3-(2-methylphenyl)prop-2-enoic Acid

There total 2 articles about 2-benzamido-3-(2-methylphenyl)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: 65.0%

(Z)-2-phenyl-4-(2-methylbenzylidene)-(4H)-1,3-oxazol-5-one (53949-13-6) → (Z)-2-Benzoylamino-3-o-tolyl-acrylic acid (72615-62-4)

Guidance literature:

With potassium carbonate; In water; acetone; Heating;

DOI:10.1021/je60084a033

Reference yield:

benzaldehyde (100-52-7) → (Z)-2-Benzoylamino-3-o-tolyl-acrylic acid (72615-62-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 41 percent / KHCO₃, acetic anhydride

2: 65 percent / K₂CO₃ / acetone; H₂O / Heating

With acetic anhydride; potassium carbonate; potassium hydrogencarbonate; In water; acetone;

DOI:10.1021/je60084a033

Reference yield:

(Z)-2-Benzoylamino-3-o-tolyl-acrylic acid (72615-62-4) → (S)-2-Benzoylamino-3-o-tolyl-propionic acid + (R)-2-Benzoylamino-3-o-tolyl-propionic acid

Guidance literature:

With (+)-(S)-cationic rhodium complex of "PROPHAROS"; hydrogen; In methanol; at 25 ℃; under 750.06 Torr; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1016/S0957-4166(00)86017-6

upstream raw materials:

(Z)-2-phenyl-4-(2-methylbenzylidene)-(4H)-1,3-oxazol-5-one

benzaldehyde