Methyl 3-(4-methoxyphenyl)propanoate

Base Information

• Chemical Name: Methyl 3-(4-methoxyphenyl)propanoate
• CAS No.: 15823-04-8
• Molecular Formula: C11H14O3
• Molecular Weight: 194.23
• Hs Code.: 2918990090
• NSC Number: 174074
• DSSTox Substance ID: DTXSID60306095
• Nikkaji Number: J104.012J
• Wikidata: Q72492674
• ChEMBL ID: CHEMBL2252077
• Mol file: 15823-04-8.mol

Synonyms:Methyl 3-(4-methoxyphenyl)propanoate;15823-04-8;Methyl 3-(4-methoxyphenyl)propionate;Benzenepropanoic acid, 4-methoxy-, methyl ester;Methyl 4-methoxyphenylpropionate;Hydrocinnamic acid, p-methoxy-, methyl ester;Methyl 3-(p-methoxyphenyl)-propionate;Methyl p-methoxyhydrocinnamate;NSC 174074;3-(4-methoxyphenyl)propionic acid methyl ester;NSC174074;SCHEMBL1445627;CHEMBL2252077;DTXSID60306095;methyl 3-(p-methoxyphenyl)propionate;MFCD01923356;STK424581;AKOS003271657;Methyl 3-(4-methoxyphenyl)-propionate;NSC-174074;AS-12444;METHYL3-(4-METHOXYPHENYL)PROPIONATE;CS-0023821;FT-0747644;Methyl 3-(4-methoxyphenyl)propionate, 97%;F52669;J-009483;Propanoic acid, 3-(4-methoxyphenyl), methyl ester

Chemical Property of Methyl 3-(4-methoxyphenyl)propanoate

Chemical Property:

• Vapor Pressure: 0.00553mmHg at 25°C
• Melting Point: 37-41 °C
• Refractive Index: 1.497
• Boiling Point: 274.1 °C at 760 mmHg
• Flash Point: 109.6 °C
• PSA: 35.53000
• Density: 1.062 g/cm³
• LogP: 1.80080
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 194.094294304
• Heavy Atom Count: 14
• Complexity: 171

Purity/Quality:

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

Methyl3-(4-Methoxyphenyl)propanoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)CCC(=O)OC

Technology Process of Methyl 3-(4-methoxyphenyl)propanoate

There total 43 articles about Methyl 3-(4-methoxyphenyl)propanoate 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: 100.0%

methanol (67-56-1) + 3-(4-methoxyphenyl)propanoic acid (1929-29-9) → methyl 3-(4-methoxyphenyl)propionate (15823-04-8)

Guidance literature:

3-(4-methoxyphenyl)propanoic acid; With 1H-imidazole; iodine; tris-(o-tolyl)phosphine; In dichloromethane; at 20 ℃; for 0.0833333h;

methanol; In dichloromethane; at 20 ℃;

DOI:10.1021/jo102395c

Reference yield: 100.0%

3-(4-methoxyphenyl)propanoic acid (1929-29-9) + carbonic acid dimethyl ester (616-38-6) → methyl 3-(4-methoxyphenyl)propionate (15823-04-8)

Guidance literature:

With Novozym 435; acylase I from Aspergillus melleus; amano lipase AK from pseudomonas fluorescens; lipase from wheat germ; papaine; In toluene; at 40 ℃; for 48h; Mechanism; Enzymatic reaction;

DOI:10.1016/j.molcatb.2014.02.020

Reference yield: 99.0%

3-(4-methoxy-phenyl)acrylic acid methyl ester (3901-07-3) → methyl 3-(4-methoxyphenyl)propionate (15823-04-8)

Guidance literature:

With hydrogen; palladium on activated charcoal; In ethanol; at 25 ℃; for 1h; under 2327.2 Torr;

DOI:10.1080/00397919108055457

upstream raw materials:

methanol

3-(4-methoxyphenyl)propanoic acid

3-(4-methoxy-phenyl)acrylic acid methyl ester

4-hydroxyphenylpropionic acid

Downstream raw materials:

3-(4-methoxyphenyl)propanoic acid

3-(4-methoxy-phenyl)propionamide

3-(4-methoxyphenyl)propionic acid hydrazide

methyl 2-<4-(1-hydroxy-1,3-dimethyl-3-butenyl)phenyl>-propionate

Refernces

• 1、 Larionova, Natalia A.,Ondozabal, Jun Miyatake,Cambeiro, Xacobe C.. "Reduction of Electron-Deficient Alkenes Enabled by a Photoinduced Hydrogen Atom Transfer". supporting information. p. 558 - 564. Retrieved 2020/12/07.
• 2、 Wei, Kaijie,Yang, Tonghao,Chen, Qing,Liang, Siyu,Yu, Wei. "Iron-catalysed 1,2-aryl migration of tertiary azides". supporting information. p. 11685 - 11688. Retrieved 2020/10/19.