3-FURANCARBOXYLIC ACID, TETRAHYDRO-2-OXO-, METHYL ESTER

Base Information

• Chemical Name: 3-FURANCARBOXYLIC ACID, TETRAHYDRO-2-OXO-, METHYL ESTER
• CAS No.: 19406-00-9
• Molecular Formula: C₆H₈O₄
• Molecular Weight: 144.127
• Hs Code.: 2932209090
• Mol file: 19406-00-9.mol

Synonyms:3-Furoicacid, tetrahydro-2-oxo-, methyl ester (8CI); Malonic acid, (2-hydroxyethyl)-, g-lactone, methyl ester (6CI);2-Methoxycarbonyl-1,4-butyrolactone; 2-Oxotetrahydrofuran-3-carboxylic acidmethyl ester; Methyl 2-oxotetrahydrofuran-3-carboxylate; Methyltetrahydro-2-oxo-3-furancarboxylate; Methyl tetrahydro-2-oxo-3-furoate; NSC238957

Chemical Property of 3-FURANCARBOXYLIC ACID, TETRAHYDRO-2-OXO-, METHYL ESTER

Chemical Property:

• Vapor Pressure: 0.00882mmHg at 25°C
• Boiling Point: 266.1°C at 760 mmHg
• PKA: 13.12±0.20(Predicted)
• Flash Point: 138.5°C
• PSA: 52.60000
• Density: 1.265g/cm³
• LogP: -0.27750
• Storage Temp.: 2-8°C

Purity/Quality:

99% ^*data from raw suppliers

Methyl2-oxotetrahydrofuran-3-carboxylate 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 3-FURANCARBOXYLIC ACID, TETRAHYDRO-2-OXO-, METHYL ESTER

There total 11 articles about 3-FURANCARBOXYLIC ACID, TETRAHYDRO-2-OXO-, METHYL ESTER 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%

4-butanolide (96-48-0) + carbonic acid dimethyl ester (616-38-6) → 2-oxotetrahydrofuran-3-carboxylic acid methyl ester (127915-15-5,19406-00-9)

Guidance literature:

With sodium hydride; at 45 - 50 ℃; for 1.5h;

Reference yield: 92.0%

dimethyl 1,1-cyclopropanedicarboxylate (6914-71-2,151444-20-1) → 2-oxotetrahydrofuran-3-carboxylic acid methyl ester (127915-15-5,19406-00-9)

Guidance literature:

With perchloric acid; In benzene; at 50 ℃; for 24h;

Reference yield: 76.0%

methanol (67-56-1) + malonic acid dimethyl ester (108-59-8) → 2-oxotetrahydrofuran-3-carboxylic acid methyl ester (127915-15-5,19406-00-9) + 2-(2-Hydroxy-ethyl)-malonic acid dimethyl ester

Guidance literature:

With europioum(III) chloride; for 22h; Irradiation;

DOI:10.1246/bcsj.61.2229

upstream raw materials:

4-butanolide

carbonic acid dimethyl ester

dimethyl 1,1-cyclopropanedicarboxylate

methanol

Downstream raw materials:

4-[4,6-dichloro-5-(2-chloroethyl)-pyrimidin-2-yl]-morpholine

1-[4-[2-[bis[(4-methoxyphenyl)methyl]amino]pyrimidin-5-yl]-2-morpholino-5,6-dihydro-pyrrolo[2,3-d]pyrimidin-7-yl]ethanone

4-[4-chloro-7-[(4-methoxyphenyl)methyl]-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-yl]morpholine

6-chloro-5-(2-chloroethyl)-N-[(4-methoxyphenyl)methyl]-2-morpholinopyrimidin-4-amine

Refernces

• 1、 Duchemin, Nicolas,Buccafusca, Roberto,Daumas, Marc,Ferey, Vincent,Arseniyadis, Stellios. "A Unified Strategy for the Synthesis of Difluoromethyl- And Vinylfluoride-Containing Scaffolds". supporting information. p. 8205 - 8210. Retrieved 2019/10/16.
• 2、 Kawada, Hatsuo,Ebiike, Hirosato,Tsukazaki, Masao,Nakamura, Mitsuaki,Morikami, Kenji,Yoshinari, Kiyoshi,Yoshida, Miyuki,Ogawa, Kotaro,Shimma, Nobuo,Tsukuda, Takuo,Ohwada, Jun. "Lead optimization of a dihydropyrrolopyrimidine inhibitor against phosphoinositide 3-kinase (PI3K) to improve the phenol glucuronic acid conjugation". supporting information. p. 673 - 678. Retrieved 2013/02/23.