[(4-Methylphenyl)amino](phenyl)acetic acid

Base Information

• Chemical Name: [(4-Methylphenyl)amino](phenyl)acetic acid
• CAS No.: 60561-72-0
• Molecular Formula: C15H15NO2
• Molecular Weight: 241.29
• NSC Number: 201726
• DSSTox Substance ID: DTXSID40308052

Synonyms:60561-72-0;[(4-methylphenyl)amino](phenyl)acetic acid;CHEMBRDG-BB 4140255;2-[(4-methylphenyl)amino]-2-phenyl-acetic acid;2-(4-methylanilino)-2-phenylacetic acid;NSC201726;Maybridge3_004628;Oprea1_684409;SCHEMBL2482091;DTXSID40308052;HMS1444C08;CCG-54278;(4-Methylanilino)(phenyl)acetic acid;AKOS005797126;NSC-201726;IDI1_016015;SR-01000643384-1

Chemical Property of [(4-Methylphenyl)amino](phenyl)acetic acid

Chemical Property:

• Vapor Pressure: 8.99E-08mmHg at 25°C
• Boiling Point: 419.1°Cat760mmHg
• Flash Point: 207.3°C
• Density: 1.22g/cm³
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 241.110278721
• Heavy Atom Count: 18
• Complexity: 266

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of [(4-Methylphenyl)amino](phenyl)acetic acid

There total 14 articles about [(4-Methylphenyl)amino](phenyl)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: 78.0%

2-bromophenylacetic acid (4870-65-9,31302-84-8) + p-toluidine (106-49-0,12221-03-3) → (4-methyl-anilino)-phenyl-acetic acid (60561-72-0)

Guidance literature:

In acetonitrile; at 100 ℃; for 1h; microwave irradiation;

Reference yield: 60.0%

carbon dioxide (124-38-9,18923-20-1) + benzal-p-toluidine (2272-45-9) → (4-methyl-anilino)-phenyl-acetic acid (60561-72-0)

Guidance literature:

With chloro-trimethyl-silane; magnesium; triethylamine; In N,N-dimethyl-formamide; at 20 ℃; for 24h; under 34202.3 Torr; Autoclave;

DOI:10.1039/c3cc42057d

Reference yield:

hydrogenchloride (7647-01-0,15364-23-5) + 2,5-diphenyl-1-p-tolyl-1,5-dihydro-imidazol-4-one (75619-96-4) → (4-methyl-anilino)-phenyl-acetic acid (60561-72-0) + ammonia (7664-41-7) + benzaldehyde (100-52-7)

Guidance literature:

at 120 ℃; im geschlossenen Rohr;

upstream raw materials:

hydrogenchloride

2,5-diphenyl-1-p-toluidino-imidazolidin-4-one

2,5-diphenyl-1-p-tolyl-1,5-dihydro-imidazol-4-one

p-toluidine

Downstream raw materials:

4-phenyl-3-p-tolylsydnone

4-methyl-phenyl-amino-phenyl-acetic acid (R)-(1-aza-bicyclo[2.2.2]oct-3-yl)ester

7-diethylamino-6-methyl-4-phenyl-3-p-tolyl-2,2-bis-trifluoromethyl-3,4-dihydro-2H-[1,3]oxazepin-5-one

4-phenyl-3-p-tolyl-2,2-bis-trifluoromethyl-oxazolidin-5-one

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