Methyl dibenzo[b,d]furan-4-carboxylate

Base Information

• Chemical Name: Methyl dibenzo[b,d]furan-4-carboxylate
• CAS No.: 92151-89-8
• Molecular Formula: C₁₄H₁₀O₃
• Molecular Weight: 226.232
• European Community (EC) Number: 659-682-9
• Mol file: 92151-89-8.mol

Synonyms:Methyl dibenzo[b,d]furan-4-carboxylate;92151-89-8;Methyl Dibenzofuran-4-carboxylate;C14H10O3;METHYL 4-DIBENZOFURANCARBOXYLATE;SCHEMBL516174;ZBKHXDCUAQMZNR-UHFFFAOYSA-N;Methyldibenzo[b,d]furan-4-carboxylate;AKOS024338445;dibenzofuran-4-carboxylic acid methyl ester;A903091;METHYL 8-OXATRICYCLO[7.4.0.0(2),?]TRIDECA-1(9),2(7),3,5,10,12-HEXAENE-6-CARBOXYLATE

Chemical Property of Methyl dibenzo[b,d]furan-4-carboxylate

Chemical Property:

• Melting Point: 142-144 °C
• Boiling Point: 361.4±15.0 °C(Predicted)
• Density: 1.268±0.06 g/cm3(Predicted)
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 226.062994177
• Heavy Atom Count: 17
• Complexity: 302

Purity/Quality:

97% ^*data from raw suppliers

Methyldibenzo[b,d]furan-4-carboxylate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC(=O)C1=CC=CC2=C1OC3=CC=CC=C23

Technology Process of Methyl dibenzo[b,d]furan-4-carboxylate

There total 3 articles about Methyl dibenzo[b,d]furan-4-carboxylate 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: 96.0%

methyl 3-nitro-2-phenoxybenzoate → methyl dibenzo[b,d]furan-4-carboxylate (92151-89-8)

Guidance literature:

With potassium phosphate; dicyclohexyl-(2′,4′,6′-triisopropyl-3,6-dimethoxy-[1,1′-biphenyl]-2-yl)phosphine; palladium(II) acetylacetonate; In toluene; at 150 ℃; for 24h; Inert atmosphere; Sealed tube;

DOI:10.1021/acs.orglett.9b01593

Reference yield:

methanol (67-56-1) + dibenzofuran-4-carboxylic acid (2786-05-2) → methyl dibenzo[b,d]furan-4-carboxylate (92151-89-8)

Guidance literature:

With hydrogenchloride;

DOI:10.1021/ja01872a030

Reference yield:

methanol (67-56-1) + dibenzofuran carboxylic acid chloride (66283-60-1) → methyl dibenzo[b,d]furan-4-carboxylate (92151-89-8)

Guidance literature:

DOI:10.1021/ja01872a030

upstream raw materials:

methanol

dibenzofuran carboxylic acid chloride

dibenzofuran-4-carboxylic acid

Downstream raw materials:

3-nitrodibenzofuran

2-acetyldibenzofuran