3-(2-CARBOXYPHENYL)PROPIONIC ACID

Base Information

• Chemical Name: 3-(2-CARBOXYPHENYL)PROPIONIC ACID
• CAS No.: 776-79-4
• Molecular Formula: C10H10O4
• Molecular Weight: 194.187
• Hs Code.: 2917399090
• Mol file: 776-79-4.mol

Synonyms:Hydrocinnamicacid, o-carboxy- (6CI,7CI,8CI);2-(2-Carboxyethyl)benzoic acid;2-Carboxybenzenepropanoic acid;2-Carboxyhydrocinnamic acid;NSC 16637;Tetralic acid;o-Carboxyhydrocinnamic acid;

Chemical Property of 3-(2-CARBOXYPHENYL)PROPIONIC ACID

Chemical Property:

• Vapor Pressure: 6.3E-07mmHg at 25°C
• Melting Point: 166-168 °C
• Refractive Index: 1.585
• Boiling Point: 394.4 °C at 760 mmHg
• PKA: 3.99±0.36(Predicted)
• Flash Point: 206.5 °C
• PSA: 74.60000
• Density: 1.33 g/cm³
• LogP: 1.40200
• Storage Temp.: Sealed in dry,Room Temperature

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-(2-Carboxyethyl)benzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 37/38-41
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Description: 3-(2-Carboxyphenyl) propionic acid is a chemical compound that belongs to the group of phytoalexins. It is a synthetic compound that is used as a raw material for the synthesis of various pharmaceuticals and additional organic compounds. 3-(2-Carboxyphenyl) propionic acid has shown luminescence properties, which may be due to its oxidation products. The isoquinoline alkaloids present in this compound are responsible for its anti-inflammatory effects. 3-(2-Carboxyphenyl) propionic acid can also be found in conjugates with chloride or other organic acids, such as diazide, which inhibit bacterial growth and increase the solubility of this substance.

Technology Process of 3-(2-CARBOXYPHENYL)PROPIONIC ACID

There total 78 articles about 3-(2-CARBOXYPHENYL)PROPIONIC 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: 99.0%

2-carboxycinnamic acid (612-40-8) → 2-(2-carboxyethyl)benzoic acid (776-79-4)

Guidance literature:

2-carboxycinnamic acid; With formic acid; sodium hydroxide; palladium dichloride; In water; at 65 ℃; for 24h;

With hydrogenchloride; In water; pH=1 - 2;

DOI:10.1016/j.tet.2009.01.119

Reference yield: 96.0%

3-(2-(methoxycarbonyl)phenyl)propanoic acid (81329-74-0) → 2-(2-carboxyethyl)benzoic acid (776-79-4)

Guidance literature:

With sodium hydroxide; In water; at 20 ℃; for 20h;

DOI:10.1002/ejoc.201701642

Reference yield: 95.0%

(E)-o-carboxycinnamic acid (18454-53-0) → 2-(2-carboxyethyl)benzoic acid (776-79-4)

Guidance literature:

With formic acid; sodium hydroxide; palladium dichloride; at 65 ℃; for 24h;

DOI:10.1080/10286020.2013.879121

upstream raw materials:

1,2-Dihydronaphthalene

2-carboxycinnamic acid

1,2,3,4-tetrahydronaphthalen-2 ol

3-(2-cyanophenyl)propionic acid

Downstream raw materials:

2-(2-Allyloxycarbonyl-ethyl)-benzoic acid

2-(3-ethoxy-3-oxopropyl)benzoic acid

carbon dioxide

water

Refernces

• 1、 Uthoff, Florian,L?we, Jana,Harms, Christina,Donsbach, Kai,Gr?ger, Harald. "Chemoenzymatic Synthesis of a Chiral Ozanimod Key Intermediate Starting from Naphthalene as Cheap Petrochemical Feedstock". . p. 4856 - 4866. Retrieved 2019/05/02.
• 2、 -. "Preparation method of carboxylic acid compound". Paragraph 0113; 0206-0208. . Retrieved 2017/08/29.