Methyl 3-formylacrylate

Base Information

• Chemical Name: Methyl 3-formylacrylate
• CAS No.: 7327-99-3
• Molecular Formula: C5H6 O3
• Molecular Weight: 114.101
• Hs Code.: 2918300090
• DSSTox Substance ID: DTXSID501312956
• Mol file: 7327-99-3.mol

Synonyms:methyl 3-formylacrylate;methyl 4-oxo-butenoate;4-oxo-butenoic acid methyl ester;DTXSID501312956;FT-0693564;D90666

Chemical Property of Methyl 3-formylacrylate

Chemical Property:

• Vapor Pressure: 0.722mmHg at 25°C
• Boiling Point: 184.8°C at 760 mmHg
• Flash Point: 71.2°C
• PSA: 43.37000
• Density: 1.081g/cm³
• LogP: -0.08550
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 114.031694049
• Heavy Atom Count: 8
• Complexity: 115

Purity/Quality:

99% ^*data from raw suppliers

METHYL-4-OXOBUT-2-ENOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C=CC=O

Technology Process of Methyl 3-formylacrylate

There total 1 articles about Methyl 3-formylacrylate 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:

4,4-dimethoxy-2-butenoic acid methyl ester → 4-oxo-but-2-enoic acid methyl ester (7327-99-3)

Guidance literature:

With toluene-4-sulfonic acid; In water; acetone; at 0 - 80 ℃;

DOI:10.1002/anie.201903973

Reference yield: 100.0%

4-oxo-but-2-enoic acid methyl ester (7327-99-3) + benzylamine (100-46-9) → C31H35N3O4

Guidance literature:

In chloroform; at 20 ℃; for 5h;

DOI:10.1016/j.tetlet.2012.08.081

Reference yield: 100.0%

4-oxo-but-2-enoic acid methyl ester (7327-99-3) + 4-methoxy-benzylamine (2393-23-9) → C34H41N3O7

Guidance literature:

In chloroform; at 20 ℃; for 5h;

DOI:10.1016/j.tetlet.2012.08.081

Downstream raw materials:

(R)-4-oxo-2-(4-dimethylamino-phenyl)-butyric acid methyl ester

(R)-4-oxo-2-(4-pyrrolidin-1-yl-phenyl)-butyric acid methyl ester

(R)-4-oxo-2-(4-dimethylamino-2-methoxyphenyl)-butyric acid methyl ester

(R)-4-oxo-2-(4-dibenzylaminophenyl)-butyric acid methyl ester