Methyl 3-bromo-4-oxo-2,4-diphenylbutanoate

Base Information

• Chemical Name: Methyl 3-bromo-4-oxo-2,4-diphenylbutanoate
• CAS No.: 6267-06-7
• Molecular Formula: C₁₇H₁₅BrO₃
• Molecular Weight: 347.208
• NSC Number: 36677
• DSSTox Substance ID: DTXSID50284313
• Mol file: 6267-06-7.mol

Synonyms:6267-06-7;methyl 3-bromo-4-oxo-2,4-diphenylbutanoate;NSC36677;DTXSID50284313;NSC-36677

Chemical Property of Methyl 3-bromo-4-oxo-2,4-diphenylbutanoate

Chemical Property:

• Vapor Pressure: 6.82E-08mmHg at 25°C
• Boiling Point: 438.6°Cat760mmHg
• Flash Point: 219.1°C
• Density: 1.394g/cm³
• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 346.02046
• Heavy Atom Count: 21
• Complexity: 357

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C(C1=CC=CC=C1)C(C(=O)C2=CC=CC=C2)Br

Technology Process of Methyl 3-bromo-4-oxo-2,4-diphenylbutanoate

There total 7 articles about Methyl 3-bromo-4-oxo-2,4-diphenylbutanoate 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:

→ 3-bromo-4-oxo-2,4-diphenyl-butyric acid methyl ester (6267-06-7)

Guidance literature:

With methanol; higher-melting form;

Reference yield:

→ 3-bromo-4-oxo-2,4-diphenyl-butyric acid methyl ester (6267-06-7)

Guidance literature:

With chloroform; lower-melting form; durch Bromierung;

Reference yield:

→ 3-bromo-4-oxo-2,4-diphenyl-butyric acid methyl ester (6267-06-7)

Guidance literature:

With chloroform; higher-melting form; durch Bromierung;

upstream raw materials:

chloroform

methyl 4-oxo-2,4-diphenylbutanoate

4-benzoyl-3-phenyl-oxetan-2-one

methanol

Downstream raw materials:

4-oxo-2,4-diphenyl-crotonic acid

4-oxo-2,4-diphenyl-cis-crotonic acid

3,5-diphenyl-[1,2]oxazin-6-one