Ethyl 3-(2-formylphenyl)prop-2-enoate

Base Information

• Chemical Name: Ethyl 3-(2-formylphenyl)prop-2-enoate
• CAS No.: 86867-62-1
• Molecular Formula: C12H12O3
• Molecular Weight: 204.225
• Hs Code.: 2918300090
• DSSTox Substance ID: DTXSID10694873
• Mol file: 86867-62-1.mol

Synonyms:ethyl 3-(2-formylphenyl)prop-2-enoate;SCHEMBL6406403;DTXSID10694873;YTQRPRCIESSITI-UHFFFAOYSA-N;ethyl 3-(2-formylphenyl)propenate;FT-0625952

Chemical Property of Ethyl 3-(2-formylphenyl)prop-2-enoate

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.586
• Boiling Point: 341.421 °C at 760 mmHg
• Flash Point: 151.273 °C
• PSA: 43.37000
• Density: 1.144 g/cm³
• LogP: 2.07540
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 204.078644241
• Heavy Atom Count: 15
• Complexity: 245

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C=CC1=CC=CC=C1C=O

Technology Process of Ethyl 3-(2-formylphenyl)prop-2-enoate

There total 27 articles about Ethyl 3-(2-formylphenyl)prop-2-enoate 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: 95.0%

ortho-bromobenzaldehyde (6630-33-7) + ethyl acrylate (140-88-5,9003-32-1) → ethyl 3-(2-formylphenyl)acrylate (86867-62-1)

Guidance literature:

With [Pd(3-((1-ethyl-1H-benzimidazol-2-yl)methyl)-1-((6-methylpyridin-2-yl)-methyl)benzimidazolylidene)2](PF₆)₂; potassium carbonate; In N,N-dimethyl-formamide; at 100 ℃; for 24h; Inert atmosphere; Schlenk technique;

DOI:10.1002/aoc.3030

Reference yield: 94.0%

acrylic acid methyl ester (292638-85-8,9003-21-8,96-33-3) + ortho-bromobenzaldehyde (6630-33-7) → ethyl 3-(2-formylphenyl)acrylate (86867-62-1)

Guidance literature:

With potassium phosphate; at 40 ℃; for 1h; Catalytic behavior;

DOI:10.1007/s10562-020-03487-3

Reference yield: 92.0%

2-chloro-benzaldehyde (89-98-5) + ethyl acrylate (140-88-5,9003-32-1) → ethyl 3-(2-formylphenyl)acrylate (86867-62-1)

Guidance literature:

With [Pd(3-((1-ethyl-1H-benzimidazol-2-yl)methyl)-1-((6-methylpyridin-2-yl)-methyl)benzimidazolylidene)2](PF₆)₂; potassium carbonate; In N,N-dimethyl-formamide; at 100 ℃; for 24h; Inert atmosphere; Schlenk technique;

DOI:10.1002/aoc.3030

upstream raw materials:

(E)-2-(2-ethoxycarbonylethenyl)benzaldehyde ethylene acetal

ethyl (triphenylphosphoranylidene)acetate

o-phthalic dicarboxaldehyde

2-<2-(1,3-dioxolanyl)>benzaldehyde

Downstream raw materials:

(E)-3-[2-((2S,4S,5S)-3,4-Dimethyl-5-phenyl-oxazolidin-2-yl)-phenyl]-acrylic acid ethyl ester

(E)-3-{2-[(E)-2-(5-Methoxy-2-methyl-phenyl)-vinyl]-phenyl}-acrylic acid ethyl ester

ethyl 2-(isoindolin-1-yl)acetate

ethyl (2E)-3-(2-vinylphenyl)prop-2-enoate