alpha-[(4-Methoxybenzoyl)methylamino]benzeneacetic acid

Base Information

• Chemical Name: alpha-[(4-Methoxybenzoyl)methylamino]benzeneacetic acid
• CAS No.: 28544-46-9
• Molecular Formula: C17H17NO4
• Molecular Weight: 299.326
• DSSTox Substance ID: DTXSID101224040
• Mol file: 28544-46-9.mol

Synonyms:alpha-[(4-Methoxybenzoyl)methylamino]benzeneacetic acid;DTXSID101224040;28544-46-9

Chemical Property of alpha-[(4-Methoxybenzoyl)methylamino]benzeneacetic acid

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 299.11575802
• Heavy Atom Count: 22
• Complexity: 384

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of alpha-[(4-Methoxybenzoyl)methylamino]benzeneacetic acid

There total 1 articles about alpha-[(4-Methoxybenzoyl)methylamino]benzeneacetic 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:

→ [(4-methoxy-benzoyl)-methyl-amino]-phenyl-acetic acid (28544-46-9)

Guidance literature:

Reference yield: 75.0%

[(4-methoxy-benzoyl)-methyl-amino]-phenyl-acetic acid (28544-46-9) + 4-chloro-3-diethylamino-4-(4-methoxyphenyl)-4,5H-isothiazolin-1,1-dioxide (141855-74-5) → 3-diethylamino-3a,6-di-(4-methoxyphenyl)-5-methyl-4-phenyl-pyrrolo<3,4-d>isothiazole 1,1-dioxide

Guidance literature:

With acetic anhydride; In toluene; at 80 ℃;

DOI:10.1016/0040-4020(94)01110-L

Reference yield: 10.0%

[(4-methoxy-benzoyl)-methyl-amino]-phenyl-acetic acid (28544-46-9) + ((Z)-2-Carboxy-vinyl)-triphenyl-phosphonium; bromide → 2-(4-methoxyphenyl)-5-phenyl-N-methylpyrrole + N-methyl-5-(4-methoxyphenyl)-2-phenyl-pyrrole-3-carboxylic acid + N-methyl-2-(4-methoxyphenyl)-5-phenyl-pyrrole-3-carboxylic acid

Guidance literature:

With acetic anhydride; In dichloromethane; for 1h; Yield given. Yields of byproduct given; Heating;

DOI:10.1016/S0040-4020(98)00264-6

Downstream raw materials:

2-(4-methoxy-phenyl)-3-methyl-5-oxo-4-phenyl-4,5-dihydro-oxazolium betaine

2-(4-Methoxy-phenyl)-1-methyl-4,5-diphenyl-1H-pyrrole-3-carboxylic acid methyl ester

2-(4-Methoxy-phenyl)-1-methyl-4,5-diphenyl-1H-pyrrole-3-carbonitrile

2-(4-Methoxy-phenyl)-1-methyl-4,5-diphenyl-2,3-dihydro-1H-pyrrole-3-carbonitrile