4-Methylphenyl2-furoate

Base Information

• Chemical Name: 4-Methylphenyl2-furoate
• CAS No.: 17357-60-7
• Molecular Formula: C12H10O3
• Molecular Weight: 202.20600
• DSSTox Substance ID: DTXSID401299672
• Nikkaji Number: J1.036.074I
• Mol file: 17357-60-7.mol

Synonyms:4-methylphenyl2-furoate;(4-methylphenyl) furan-2-carboxylate;SCHEMBL14130698;4-Methylphenyl 2-furancarboxylate;DTXSID401299672;AKOS000522822;2-Furancarboxylic acid 4-methylphenyl ester;AE-848/32329035;17357-60-7

Chemical Property of 4-Methylphenyl2-furoate

Chemical Property:

• PSA: 39.44000
• LogP: 2.80720
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 202.062994177
• Heavy Atom Count: 15
• Complexity: 219

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)OC(=O)C2=CC=CO2

Technology Process of 4-Methylphenyl2-furoate

There total 4 articles about 4-Methylphenyl2-furoate 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: 71.0%

2-furancarbonyl chloride (527-69-5) + p-cresol (106-44-5) → p-tolyl furan-2-carboxylate (17357-60-7)

Guidance literature:

With triethylamine; In dichloromethane; at 20 ℃; for 0.5h;

DOI:10.1002/jhet.5570390615

Reference yield: 70.0%

2-furanoic acid (88-14-2) + p-cresol (106-44-5) → p-tolyl furan-2-carboxylate (17357-60-7)

Guidance literature:

With pyridine; trichlorophosphate;

Reference yield:

p-cresol (106-44-5) + C12H12N2O6 → p-tolyl furan-2-carboxylate (17357-60-7)

Guidance literature:

With zinc trifluoromethanesulfonate; potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 21h;

DOI:10.1002/adsc.201701646

upstream raw materials:

2-furancarbonyl chloride

p-cresol

2-furanoic acid

N-methoxyfuran-2-carboxamide

Downstream raw materials:

(2-hydroxy-5-methylphenyl)furan-2-ylmethanone

α-Methyl-α-(2-hydroxy-5-methylphenyl)-2-furanmethanol