Methyl 5-methylfuran-2-carboxylate

Base Information

• Chemical Name: Methyl 5-methylfuran-2-carboxylate
• CAS No.: 2527-96-0
• Molecular Formula: C7H8O3
• Molecular Weight: 140.139
• Hs Code.: 2932190090
• European Community (EC) Number: 672-136-4
• DSSTox Substance ID: DTXSID40179921
• Nikkaji Number: J1.429.892D
• Wikidata: Q72491031
• Mol file: 2527-96-0.mol

Synonyms:2527-96-0;Methyl 5-methyl-2-furoate;methyl 5-methylfuran-2-carboxylate;2-Furancarboxylic acid, 5-methyl-, methyl ester;MFCD04116374;5-Methylfuran-2-carboxylic acid methyl ester;Methyl5-methylfuran-2-carboxylate;SCHEMBL423503;DTXSID40179921;methyl 5-methyl-2-furancarboxylate;Methyl 5-methyl-2-furoate, 97%;GEO-01875;AKOS000295902;CS-W005869;DS-4583;SB61463;SY101281;FT-0628682;EN300-136837;Y10250;A817755;W-200258;2-methyl-1,3-bis[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]propan-2-amine;Methyl 5-methylfuran-2-carboxylate

Chemical Property of Methyl 5-methylfuran-2-carboxylate

Chemical Property:

• Vapor Pressure: 0.256mmHg at 25°C
• Refractive Index: 1.493
• Boiling Point: 205 °C at 760 mmHg
• Flash Point: 74.5 °C
• PSA: 39.44000
• Density: 1.108 g/cm³
• LogP: 1.37460
• Storage Temp.: Sealed in dry,Room Temperature
• Water Solubility.: Insoluble in water.
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 140.047344113
• Heavy Atom Count: 10
• Complexity: 133

Purity/Quality:

98%,99%, ^*data from raw suppliers

Methyl 5-methyl-2-furoate ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36-36/37

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=CC=C(O1)C(=O)OC
• Uses: Furans with suitable substituent in the 2- positions may be transformed into other systems with aromatic character with methoxylation of cyclic acetals of 1,4- dicarbonyl compounds, followed by intramolecular condensations in the acid solutions.

Technology Process of Methyl 5-methylfuran-2-carboxylate

There total 19 articles about Methyl 5-methylfuran-2-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: 95.0%

5-Methylfurfural (620-02-0) + methanol (67-56-1) → methyl 5-methyl-2-furancarboxylate (2527-96-0)

Guidance literature:

5-Methylfurfural; methanol; With sodium cyanide; at 20 ℃; for 0.0833333h;

With manganese(IV) oxide; at 40 ℃; for 12h;

DOI:10.1039/c9gc00840c

Reference yield: 94.0%

methyl 5-(chloromethyl)-2-furoate (2144-37-8) → methyl 5-methyl-2-furancarboxylate (2527-96-0)

Guidance literature:

palladium on charcoal; In hexane; ethyl acetate;

Reference yield: 80.0%

methanol (67-56-1) + 5-methylfuran-2-carboxylic acid (1917-15-3) → methyl 5-methyl-2-furancarboxylate (2527-96-0)

Guidance literature:

Amberlyst 15; In methanol; for 16h; Heating;

upstream raw materials:

methanol

5-methylfuran-2-carboxylic acid

methyl 5-(chloromethyl)-2-furoate

2-methylfuran

Downstream raw materials:

furan-2,5-dicarboxylic acid

furan-2,5-dicarboxylic acid dimethyl ester

4-(4-bromo-1-methyl-1H-pyrazol-5-yl)-N-((1S)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1-{[2-(trifluoromethyl)phenyl]methyl}ethyl)-5-methyl-2-furancarboxamide

4-(4-chloro-1-methyl-1H-pyrazol-5-yl)-N-((1S)-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1-{[2-(trifluoromethyl)phenyl]methyl}ethyl)-5-methyl-2-furancarboxamide

Refernces

• 1、 -. "Method for producing furandicarboxylic acid and derivatives thereof from furfural". . . Retrieved 2020/06/05.
• 2、 -. "ARYLDIAZEPINE DERIVATIVES AS RSV INHIBITORS". Page/Page column 60. . Retrieved 2019/01/06.