Hydrocinnamic acid, 2-(N-methylbenzamido)-

Base Information

• Chemical Name: Hydrocinnamic acid, 2-(N-methylbenzamido)-
• CAS No.: 72502-98-8
• Molecular Formula: C₁₇H₁₇NO₃
• Molecular Weight: 283.327
• DSSTox Substance ID: DTXSID70222818
• Nikkaji Number: J59.914J
• Wikidata: Q83101158
• Mol file: 72502-98-8.mol

Synonyms:2-(N-Methylbenzamido)hydrocinnamic acid;Hydrocinnamic acid, 2-(N-methylbenzamido)-;Benzenepropanoic acid, 2-(benzoylmethylamino)-;72502-98-8;SCHEMBL11256211;DTXSID70222818;LS-77212;2-(N-Methyl-N-benzoylamino)hydrocinnamic acid

Chemical Property of Hydrocinnamic acid, 2-(N-methylbenzamido)-

Chemical Property:

• Vapor Pressure: 9.4E-10mmHg at 25°C
• Boiling Point: 473°C at 760 mmHg
• Flash Point: 239.9°C
• Density: 1.227g/cm³
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 283.12084340
• Heavy Atom Count: 21
• Complexity: 363

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C1=CC=CC=C1CCC(=O)O)C(=O)C2=CC=CC=C2

Technology Process of Hydrocinnamic acid, 2-(N-methylbenzamido)-

There total 2 articles about Hydrocinnamic acid, 2-(N-methylbenzamido)- 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:

N-methyldihydrocarbostyril (826-72-2) + benzoyl chloride (98-88-4) → 3-[2-(N-methyl-benzamido)-phenyl]-propionic acid (72502-98-8)

Guidance literature:

With potassium hydroxide; sodium hydrogencarbonate; Yield given. Multistep reaction; 1.) ethylene glycol monoethyl ether, 150 deg C, 6 h, 2.) water, ether, 2 h;

DOI:10.1002/jps.2600710719

Reference yield:

→ 3-[2-(N-methyl-benzamido)-phenyl]-propionic acid (72502-98-8)

Guidance literature:

upstream raw materials:

N-methyldihydrocarbostyril

benzoyl chloride