3-(4-ACETYLAMINOBENZOYL)PROPANOIC ACID

Base Information

• Chemical Name: 3-(4-ACETYLAMINOBENZOYL)PROPANOIC ACID
• CAS No.: 5473-15-4
• Molecular Formula: C12H13 N O4
• Molecular Weight: 235.24
• Hs Code.: 2924299090
• Mol file: 5473-15-4.mol

Synonyms:Propionicacid, 3-(p-acetamidobenzoyl)- (7CI); 3-(4-Acetaminobenzoyl)propionic acid;3-(p-Acetamidobenzoyl)propionic acid; 4-(4-Acetylaminophenyl)-4-oxobutyricacid; 4-(Acetylamino)-g-oxobenzenebutanoic acid; 4-[4-(Acetylamino)phenyl]-4-oxobutanoic acid;NSC 29659; b-(p-Acetamidobenzoyl)propionicacid

Chemical Property of 3-(4-ACETYLAMINOBENZOYL)PROPANOIC ACID

Chemical Property:

• Vapor Pressure: 7.75E-13mmHg at 25°C
• Melting Point: 202～204℃
• Boiling Point: 547.9°Cat760mmHg
• PKA: 4.53±0.17(Predicted)
• Flash Point: 285.1°C
• PSA: 83.47000
• Density: 1.294g/cm³
• LogP: 1.76550

Purity/Quality:

99% ^*data from raw suppliers

4-(4-Acetamidophenyl)-4-oxobutanoicacid 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-(4-ACETYLAMINOBENZOYL)PROPANOIC ACID

There total 5 articles about 3-(4-ACETYLAMINOBENZOYL)PROPANOIC 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: 70.0%

succinic acid (110-15-6) + Acetanilid (103-84-4) → 4-(4-acetamidophenyl)-4-oxobutanoic acid (5473-15-4)

Guidance literature:

succinic acid; Acetanilid; With aluminum (III) chloride; In DMF (N,N-dimethyl-formamide); at 80 - 90 ℃; for 2h;

With hydrogenchloride; In water; pH=1;

Reference yield:

succinic acid anhydride (108-30-5) + Acetanilid (103-84-4) → 4-[4-(4-methyl-benzoylamino)-phenyl]-4-oxo-butyric acid + 4-(4-acetamidophenyl)-4-oxobutanoic acid (5473-15-4)

Guidance literature:

aluminium trichloride; In N-methyl-acetamide; methanol; water;

Reference yield:

4-(4-acetylaminophenyl)-4-oxo-but-2-enoic acid (24849-50-1) → 4-(4-acetamidophenyl)-4-oxobutanoic acid (5473-15-4)

Guidance literature:

With sodium hydroxide; Pd-BaSO₄; Hydrogenation;

DOI:10.1021/ja01102a032

upstream raw materials:

4-(4-acetylaminophenyl)-4-oxo-but-2-enoic acid

succinic acid

Acetanilid

succinic acid anhydride

Downstream raw materials:

4-(4-acetylamino-3-nitro-phenyl)-4-oxo-butyric acid

4-(4-amino-phenyl)-4-oxo-butyric acid

3-(4-acetamidobenzoyl)-4-(N-piperidinyl)butanoic acid

4-(4-acetylaminobenzoyl)-2(3H)-dihydrofuranone

Refernces

• 1、 -. "A process for synthesizing phenylbutyric acid nitrogen mustard antineoplastic agent". . . Retrieved 2018/02/04.
• 2、 -. "Benzene butyric acids and their derivatives as inhibitors of matrix metalloproteinases". . . Retrieved 2008/06/13.