2,4(1H,3H)-Pyrimidinedione, 1-(2,3-dihydro-2-furanyl)-5-fluoro-

Base Information

• Chemical Name: 2,4(1H,3H)-Pyrimidinedione, 1-(2,3-dihydro-2-furanyl)-5-fluoro-
• CAS No.: 37076-64-5
• Molecular Formula: C8H7FN2O3
• Molecular Weight: 198.154
• NSC Number: 200694
• DSSTox Substance ID: DTXSID60276289
• Nikkaji Number: J184.234J
• Mol file: 37076-64-5.mol

Synonyms:2,4(1H,3H)-Pyrimidinedione, 1-(2,3-dihydro-2-furanyl)-5-fluoro-;37076-64-5;SCHEMBL11560579;DTXSID60276289;PDLPZZHYCMXDCF-UHFFFAOYSA-N;NSC200694;NSC-200694;1-(2,3-Dihydro-2-furanyl)-5-fluorouracil;1-(4,5-DEHYDROTETRAHYDRO-2-FURANYL)-5-FLUOROURACIL;1-(2,3-Dihydro-2-furanyl)-5-fluoro-2,4(1H,3H)-pyrimidinedione #

Chemical Property of 2,4(1H,3H)-Pyrimidinedione, 1-(2,3-dihydro-2-furanyl)-5-fluoro-

Chemical Property:

• Refractive Index: 1.59
• Density: 1.51g/cm³
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 198.04407025
• Heavy Atom Count: 14
• Complexity: 351

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1C=COC1N2C=C(C(=O)NC2=O)F

Technology Process of 2,4(1H,3H)-Pyrimidinedione, 1-(2,3-dihydro-2-furanyl)-5-fluoro-

There total 2 articles about 2,4(1H,3H)-Pyrimidinedione, 1-(2,3-dihydro-2-furanyl)-5-fluoro- 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: 75.0%

5-Fluoro-2'-desoxyuridine-5'-carboxylic acid (20105-69-5) → 1-(2,3-dihydro-furan-2-yl)-5-fluoro-1H-pyrimidine-2,4-dione (37076-64-5)

Guidance literature:

With N,N-dimethylformamide dineopentyl acetal; In N,N-dimethyl-formamide; at 80 ℃;

DOI:10.1016/j.bmcl.2007.10.038

Reference yield:

→ 1-(2,3-dihydro-furan-2-yl)-5-fluoro-1H-pyrimidine-2,4-dione (37076-64-5)

Guidance literature:

Nucleosid 1c, Acetal 2b;

DOI:10.1021/ja00764a053

Reference yield: 71.0%

Phenylselenyl chloride (5707-04-0) + hydroxymethyl-phosphonic acid dimethyl ester (24630-67-9) + 1-(2,3-dihydro-furan-2-yl)-5-fluoro-1H-pyrimidine-2,4-dione (37076-64-5) → C17H20FN2O7PSe (1000863-96-6)

Guidance literature:

Phenylselenyl chloride; 1-(2,3-dihydro-furan-2-yl)-5-fluoro-1H-pyrimidine-2,4-dione; In dichloromethane; at -78 ℃;

hydroxymethyl-phosphonic acid dimethyl ester; With silver perchlorate; In dichloromethane; Further stages.;

DOI:10.1016/j.bmcl.2007.10.038

upstream raw materials:

5-Fluoro-2'-desoxyuridine-5'-carboxylic acid

Downstream raw materials:

C₁₇H₂₀FN₂O₇PSe